Recent advances in the field of machine learning open a new era in high performance computing. Applications of machine learning algorithms for the development of accurate and cost-efficient surrogates of complex problems have already attracted major attention from scientists. Despite their powerful approximation capabilities, however, surrogates cannot produce the `exact' solution to the problem. To address this issue, this paper exploits up-to-date ML tools and delivers customized iterative solvers of linear equation systems, capable of solving large-scale parametrized problems at any desired level of accuracy. Specifically, the proposed approach consists of the following two steps. At first, a reduced set of model evaluations is performed and the corresponding solutions are used to establish an approximate mapping from the problem's parametric space to its solution space using deep feedforward neural networks and convolutional autoencoders. This mapping serves a means to obtain very accurate initial predictions of the system's response to new query points at negligible computational cost. Subsequently, an iterative solver inspired by the Algebraic Multigrid method in combination with Proper Orthogonal Decomposition, termed POD-2G, is developed that successively refines the initial predictions towards the exact system solutions. The application of POD-2G as a standalone solver or as preconditioner in the context of preconditioned conjugate gradient methods is demonstrated on several numerical examples of large scale systems, with the results indicating its superiority over conventional iterative solution schemes.  ( 3 min )

Tabular data is one of the most common data storage formats in business applications, ranging from retail, bank and E-commerce. These applications rely heavily on machine learning models to achieve business success. One of the critical problems in learning tabular data is to distinguish influential features from all the predetermined features. Global feature selection has been well-studied for quite some time, assuming that all instances have the same influential feature subsets. However, different instances rely on different feature subsets in practice, which also gives rise to that instance-wise feature selection receiving increasing attention in recent studies. In this paper, we first propose a novel method for discovering instance-wise influential features for tabular data (DIWIFT), the core of which is to introduce the influence function to measure the importance of an instance-wise feature. DIWIFT is capable of automatically discovering influential feature subsets of different sizes in different instances, which is different from global feature selection that considers all instances with the same influential feature subset. On the other hand, different from the previous instance-wise feature selection, DIWIFT minimizes the validation loss on the validation set and is thus more robust to the distribution shift existing in the training dataset and test dataset, which is important in tabular data. Finally, we conduct extensive experiments on both synthetic and real-world datasets to validate the effectiveness of our DIWIFT, compared it with baseline methods. Moreover, we also demonstrate the robustness of our method via some ablation experiments.  ( 3 min )

We introduce a novel method for clustering using a semidefinite programming (SDP) relaxation of the Max k-Cut problem. The approach is based on a new methodology for rounding the solution of an SDP relaxation using iterated linear optimization. We show the vertices of the Max k-Cut relaxation correspond to partitions of the data into at most k sets. We also show the vertices are attractive fixed points of iterated linear optimization. Each step of this iterative process solves a relaxation of the closest vertex problem and leads to a new clustering problem where the underlying clusters are more clearly defined. Our experiments show that using fixed point iteration for rounding the Max k-Cut SDP relaxation leads to significantly better results when compared to randomized rounding.  ( 2 min )

Using transfer learning to adapt a pre-trained "source model" to a downstream "target task" can dramatically increase performance with seemingly no downside. In this work, we demonstrate that there can exist a downside after all: bias transfer, or the tendency for biases of the source model to persist even after adapting the model to the target class. Through a combination of synthetic and natural experiments, we show that bias transfer both (a) arises in realistic settings (such as when pre-training on ImageNet or other standard datasets) and (b) can occur even when the target dataset is explicitly de-biased. As transfer-learned models are increasingly deployed in the real world, our work highlights the importance of understanding the limitations of pre-trained source models. Code is available at https://github.com/MadryLab/bias-transfer  ( 2 min )

Markov chains are a class of probabilistic models that have achieved widespread application in the quantitative sciences. This is in part due to their versatility, but is compounded by the ease with which they can be probed analytically. This tutorial provides an in-depth introduction to Markov chains, and explores their connection to graphs and random walks. We utilize tools from linear algebra and graph theory to describe the transition matrices of different types of Markov chains, with a particular focus on exploring properties of the eigenvalues and eigenvectors corresponding to these matrices. The results presented are relevant to a number of methods in machine learning and data mining, which we describe at various stages. Rather than being a novel academic study in its own right, this text presents a collection of known results, together with some new concepts. Moreover, the tutorial focuses on offering intuition to readers rather than formal understanding, and only assumes basic exposure to concepts from linear algebra and probability theory. It is therefore accessible to students and researchers from a wide variety of disciplines.  ( 2 min )

In this paper, we study the partial multi-label (PML) image classification problem, where each image is annotated with a candidate label set consists of multiple relevant labels and other noisy labels. Existing PML methods typically design a disambiguation strategy to filter out noisy labels by utilizing prior knowledge with extra assumptions, which unfortunately is unavailable in many real tasks. Furthermore, because the objective function for disambiguation is usually elaborately designed on the whole training set, it can be hardly optimized in a deep model with SGD on mini-batches. In this paper, for the first time we propose a deep model for PML to enhance the representation and discrimination ability. On one hand, we propose a novel curriculum based disambiguation strategy to progressively identify ground-truth labels by incorporating the varied difficulties of different classes. On the other hand, a consistency regularization is introduced for model retraining to balance fitting identified easy labels and exploiting potential relevant labels. Extensive experimental results on the commonly used benchmark datasets show the proposed method significantly outperforms the SOTA methods.  ( 2 min )

Applying Differentially Private Stochastic Gradient Descent (DPSGD) to training modern, large-scale neural networks such as transformer-based models is a challenging task, as the magnitude of noise added to the gradients at each iteration scales with model dimension, hindering the learning capability significantly. We propose a unified framework, $\textsf{LSG}$, that fully exploits the low-rank and sparse structure of neural networks to reduce the dimension of gradient updates, and hence alleviate the negative impacts of DPSGD. The gradient updates are first approximated with a pair of low-rank matrices. Then, a novel strategy is utilized to sparsify the gradients, resulting in low-dimensional, less noisy updates that are yet capable of retaining the performance of neural networks. Empirical evaluation on natural language processing and computer vision tasks shows that our method outperforms other state-of-the-art baselines.  ( 2 min )

When using medical images for diagnosis, either by clinicians or artificial intelligence (AI) systems, it is important that the images are of high quality. When an image is of low quality, the medical exam that produced the image often needs to be redone. In telemedicine, a common problem is that the quality issue is only flagged once the patient has left the clinic, meaning they must return in order to have the exam redone. This can be especially difficult for people living in remote regions, who make up a substantial portion of the patients at Portal Telemedicina, a digital healthcare organization based in Brazil. In this paper, we report on ongoing work regarding (i) the development of an AI system for flagging and explaining low-quality medical images in real-time, (ii) an interview study to understand the explanation needs of stakeholders using the AI system at OurCompany, and, (iii) a longitudinal user study design to examine the effect of including explanations on the workflow of the technicians in our clinics. To the best of our knowledge, this would be the first longitudinal study on evaluating the effects of XAI methods on end-users -- stakeholders that use AI systems but do not have AI-specific expertise. We welcome feedback and suggestions on our experimental setup.  ( 3 min )

Molecular property prediction is essential in chemistry, especially for drug discovery applications. However, available molecular property data is often limited, encouraging the transfer of information from related data. Transfer learning has had a tremendous impact in fields like Computer Vision and Natural Language Processing signaling for its potential in molecular property prediction. We present a pre-training procedure for molecular representation learning using reaction data and use it to pre-train a SMILES Transformer. We fine-tune and evaluate the pre-trained model on 12 molecular property prediction tasks from MoleculeNet within physical chemistry, biophysics, and physiology and show a statistically significant positive effect on 5 of the 12 tasks compared to a non-pre-trained baseline model.  ( 2 min )

The k-medoids algorithm is a popular variant of the k-means algorithm and widely used in pattern recognition and machine learning. A main drawback of the k-medoids algorithm is that it can be trapped in local optima. An improved k-medoids algorithm (INCKM) was recently proposed to overcome this drawback, based on constructing a candidate medoids subset with a parameter choosing procedure, but it may fail when dealing with imbalanced datasets. In this paper, we propose a novel incremental k-medoids algorithm (INCKPP) which dynamically increases the number of clusters from 2 to k through a nonparametric and stochastic k-means++ search procedure. Our algorithm can overcome the parameter selection problem in the improved k-medoids algorithm, improve the clustering performance, and deal with imbalanced datasets very well. But our algorithm has a weakness in computation efficiency. To address this issue, we propose a fast INCKPP algorithm (called INCKPP$_{sample}$) which preserves the computational efficiency of the simple and fast k-medoids algorithm with an improved clustering performance. The proposed algorithm is compared with three state-of-the-art algorithms: the improved k-medoids algorithm (INCKM), the simple and fast k-medoids algorithm (FKM) and the k-means++ algorithm (KPP). Extensive experiments on both synthetic and real world datasets including imbalanced datasets illustrate the effectiveness of the proposed algorithm.  ( 2 min )

Tensor decomposition is a fundamental framework to analyze data that can be represented by multi-dimensional arrays. In practice, tensor data is often accompanied by temporal information, namely the time points when the entry values were generated. This information implies abundant, complex temporal variation patterns. However, current methods always assume the factor representations of the entities in each tensor mode are static, and never consider their temporal evolution. To fill this gap, we propose NONparametric FActor Trajectory learning for dynamic tensor decomposition (NONFAT). We place Gaussian process (GP) priors in the frequency domain and conduct inverse Fourier transform via Gauss-Laguerre quadrature to sample the trajectory functions. In this way, we can overcome data sparsity and obtain robust trajectory estimates across long time horizons. Given the trajectory values at specific time points, we use a second-level GP to sample the entry values and to capture the temporal relationship between the entities. For efficient and scalable inference, we leverage the matrix Gaussian structure in the model, introduce a matrix Gaussian posterior, and develop a nested sparse variational learning algorithm. We have shown the advantage of our method in several real-world applications.  ( 2 min )

Counterfactual explanations inform ways to achieve a desired outcome from a machine learning model. However, such explanations are not robust to certain real-world changes in the underlying model (e.g., retraining the model, changing hyperparameters, etc.), questioning their reliability in several applications, e.g., credit lending. In this work, we propose a novel strategy -- that we call RobX -- to generate robust counterfactuals for tree-based ensembles, e.g., XGBoost. Tree-based ensembles pose additional challenges in robust counterfactual generation, e.g., they have a non-smooth and non-differentiable objective function, and they can change a lot in the parameter space under retraining on very similar data. We first introduce a novel metric -- that we call Counterfactual Stability -- that attempts to quantify how robust a counterfactual is going to be to model changes under retraining, and comes with desirable theoretical properties. Our proposed strategy RobX works with any counterfactual generation method (base method) and searches for robust counterfactuals by iteratively refining the counterfactual generated by the base method using our metric Counterfactual Stability. We compare the performance of RobX with popular counterfactual generation methods (for tree-based ensembles) across benchmark datasets. The results demonstrate that our strategy generates counterfactuals that are significantly more robust (nearly 100% validity after actual model changes) and also realistic (in terms of local outlier factor) over existing state-of-the-art methods.  ( 3 min )

Cloud datacenters are exponentially growing both in numbers and size. This increase results in a network activity surge that warrants better congestion avoidance. The resulting challenge is two-fold: (i) designing algorithms that can be custom-tuned to the complex traffic patterns of a given datacenter; but, at the same time (ii) run on low-level hardware with the required low latency of effective Congestion Control (CC). In this work, we present a Reinforcement Learning (RL) based CC solution that learns from certain traffic scenarios and successfully generalizes to others. We then distill the RL neural network policy into binary decision trees to achieve the desired $\mu$sec decision latency required for real-time inference with RDMA. We deploy the distilled policy on NVIDIA NICs in a real network and demonstrate state-of-the-art performance, balancing all tested metrics simultaneously: bandwidth, latency, fairness, and packet drops.  ( 2 min )

We give a method for proactively identifying small, plausible shifts in distribution which lead to large differences in model performance. To ensure that these shifts are plausible, we parameterize them in terms of interpretable changes in causal mechanisms of observed variables. This defines a parametric robustness set of plausible distributions and a corresponding worst-case loss. While the loss under an individual parametric shift can be estimated via reweighting techniques such as importance sampling, the resulting worst-case optimization problem is non-convex, and the estimate may suffer from large variance. For small shifts, however, we can construct a local second-order approximation to the loss under shift and cast the problem of finding a worst-case shift as a particular non-convex quadratic optimization problem, for which efficient algorithms are available. We demonstrate that this second-order approximation can be estimated directly for shifts in conditional exponential family models, and we bound the approximation error. We apply our approach to a computer vision task (classifying gender from images), revealing sensitivity to shifts in non-causal attributes.

Nowadays wireless communication is rapidly reshaping entire industry sectors. In particular, mobile edge computing (MEC) as an enabling technology for industrial Internet of things (IIoT) brings powerful computing/storage infrastructure closer to the mobile terminals and, thereby, significant lowers the response latency. To reap the benefit of proactive caching at the network edge, precise knowledge on the popularity pattern among the end devices is essential. However, the complex and dynamic nature of the content popularity over space and time as well as the data-privacy requirements in many IIoT scenarios pose tough challenges to its acquisition. In this article, we propose an unsupervised and privacy-preserving popularity prediction framework for MEC-enabled IIoT. The concepts of local and global popularities are introduced and the time-varying popularity of each user is modelled as a model-free Markov chain. On this basis, a novel unsupervised recurrent federated learning (URFL) algorithm is proposed to predict the distributed popularity while achieve privacy preservation and unsupervised training. Simulations indicate that the proposed framework can enhance the prediction accuracy in terms of a reduced root-mean-squared error by up to $60.5\%-68.7\%$. Additionally, manual labeling and violation of users' data privacy are both avoided.

We introduce a new method for internal replay that modulates the frequency of rehearsal based on the depth of the network. While replay strategies mitigate the effects of catastrophic forgetting in neural networks, recent works on generative replay show that performing the rehearsal only on the deeper layers of the network improves the performance in continual learning. However, the generative approach introduces additional computational overhead, limiting its applications. Motivated by the observation that earlier layers of neural networks forget less abruptly, we propose to update network layers with varying frequency using intermediate-level features during replay. This reduces the computational burden by omitting computations for both deeper layers of the generator and earlier layers of the main model. We name our method Progressive Latent Replay and show that it outperforms Internal Replay while using significantly fewer resources.

This paper introduces a novel neural network - flow completion network (FCN) - to infer the fluid dynamics, includ-ing the flow field and the force acting on the body, from the incomplete data based on Graph Convolution AttentionNetwork. The FCN is composed of several graph convolution layers and spatial attention layers. It is designed to inferthe velocity field and the vortex force contribution of the flow field when combined with the vortex force map (VFM)method. Compared with other neural networks adopted in fluid dynamics, the FCN is capable of dealing with bothstructured data and unstructured data. The performance of the proposed FCN is assessed by the computational fluiddynamics (CFD) data on the flow field around a circular cylinder. The force coefficients predicted by our model arevalidated against those obtained directly from CFD. Moreover, it is shown that our model effectively utilizes the exist-ing flow field information and the gradient information simultaneously, giving a better performance than the traditionalconvolution neural network (CNN)-based and deep neural network (DNN)-based models. Specifically, among all thecases of different Reynolds numbers and different proportions of the training dataset, the results show that the proposedFCN achieves a maximum norm mean square error of 5.86% in the test dataset, which is much lower than those of thetraditional CNN-based and DNN-based models (42.32% and 15.63% respectively).

Recent advances in deep learning optimization showed that just a subset of parameters are really necessary to successfully train a model. Potentially, such a discovery has broad impact from the theory to application; however, it is known that finding these trainable sub-network is a typically costly process. This inhibits practical applications: can the learned sub-graph structures in deep learning models be found at training time? In this work we explore such a possibility, observing and motivating why common approaches typically fail in the extreme scenarios of interest, and proposing an approach which potentially enables training with reduced computational effort. The experiments on either challenging architectures and datasets suggest the algorithmic accessibility over such a computational gain, and in particular a trade-off between accuracy achieved and training complexity deployed emerges.

Personalized federated learning considers learning models unique to each client in a heterogeneous network. The resulting client-specific models have been purported to improve metrics such as accuracy, fairness, and robustness in federated networks. However, despite a plethora of work in this area, it remains unclear: (1) which personalization techniques are most effective in various settings, and (2) how important personalization truly is for realistic federated applications. To better answer these questions, we propose Motley, a benchmark for personalized federated learning. Motley consists of a suite of cross-device and cross-silo federated datasets from varied problem domains, as well as thorough evaluation metrics for better understanding the possible impacts of personalization. We establish baselines on the benchmark by comparing a number of representative personalized federated learning methods. These initial results highlight strengths and weaknesses of existing approaches, and raise several open questions for the community. Motley aims to provide a reproducible means with which to advance developments in personalized and heterogeneity-aware federated learning, as well as the related areas of transfer learning, meta-learning, and multi-task learning.

We propose Adversarially Trained Actor Critic (ATAC), a new model-free algorithm for offline reinforcement learning (RL) under insufficient data coverage, based on the concept of relative pessimism. ATAC is designed as a two-player Stackelberg game: A policy actor competes against an adversarially trained value critic, who finds data-consistent scenarios where the actor is inferior to the data-collection behavior policy. We prove that, when the actor attains no regret in the two-player game, running ATAC produces a policy that provably 1) outperforms the behavior policy over a wide range of hyperparameters that control the degree of pessimism, and 2) competes with the best policy covered by data with appropriately chosen hyperparameters. Compared with existing works, notably our framework offers both theoretical guarantees for general function approximation and a deep RL implementation scalable to complex environments and large datasets. In the D4RL benchmark, ATAC consistently outperforms state-of-the-art offline RL algorithms on a range of continuous control tasks.

The oceans are a source of an impressive mixture of complex data that could be used to uncover relationships yet to be discovered. Such data comes from the oceans and their surface, such as Automatic Identification System (AIS) messages used for tracking vessels' trajectories. AIS messages are transmitted over radio or satellite at ideally periodic time intervals but vary irregularly over time. As such, this paper aims to model the AIS message transmission behavior through neural networks for forecasting upcoming AIS messages' content from multiple vessels, particularly in a simultaneous approach despite messages' temporal irregularities as outliers. We present a set of experiments comprising multiple algorithms for forecasting tasks with horizon sizes of varying lengths. Deep learning models (e.g., neural networks) revealed themselves to adequately preserve vessels' spatial awareness regardless of temporal irregularity. We show how convolutional layers, feed-forward networks, and recurrent neural networks can improve such tasks by working together. Experimenting with short, medium, and large-sized sequences of messages, our model achieved 36/37/38% of the Relative Percentage Difference - the lower, the better, whereas we observed 92/45/96% on the Elman's RNN, 51/52/40% on the GRU, and 129/98/61% on the LSTM. These results support our model as a driver for improving the prediction of vessel routes when analyzing multiple vessels of diverging types simultaneously under temporally noise data.

Deep learning based singing voice synthesis (SVS) systems have been demonstrated to flexibly generate singing with better qualities, compared to conventional statistical parametric based methods. However, neural systems are generally data-hungry and have difficulty to reach reasonable singing quality with limited public available training data. In this work, we explore different data augmentation methods to boost the training of SVS systems, including several strategies customized to SVS based on pitch augmentation and mix-up augmentation. To further stabilize the training, we introduce the cycle-consistent training strategy. Extensive experiments on two public singing databases demonstrate that our proposed augmentation methods and the stabilizing training strategy can significantly improve the performance on both objective and subjective evaluations.

Sleep staging is of great importance in the diagnosis and treatment of sleep disorders. Recently, numerous data-driven deep learning models have been proposed for automatic sleep staging. They mainly train the model on a large public labeled sleep dataset and test it on a smaller one with subjects of interest. However, they usually assume that the train and test data are drawn from the same distribution, which may not hold in real-world scenarios. Unsupervised domain adaption (UDA) has been recently developed to handle this domain shift problem. However, previous UDA methods applied for sleep staging have two main limitations. First, they rely on a totally shared model for the domain alignment, which may lose the domain-specific information during feature extraction. Second, they only align the source and target distributions globally without considering the class information in the target domain, which hinders the classification performance of the model while testing. In this work, we propose a novel adversarial learning framework called ADAST to tackle the domain shift problem in the unlabeled target domain. First, we develop an unshared attention mechanism to preserve the domain-specific features in both domains. Second, we design an iterative self-training strategy to improve the classification performance on the target domain via target domain pseudo labels. We also propose dual distinct classifiers to increase the robustness and quality of the pseudo labels. The experimental results on six cross-domain scenarios validate the efficacy of our proposed framework and its advantage over state-of-the-art UDA methods. The source code is available at https://github.com/emadeldeen24/ADAST.

Density-based clustering algorithms are widely used for discovering clusters in pattern recognition and machine learning since they can deal with non-hyperspherical clusters and are robustness to handle outliers. However, the runtime of density-based algorithms are heavily dominated by finding fixed-radius near neighbors and calculating the density, which is time-consuming. Meanwhile, the traditional acceleration methods using indexing technique such as KD tree is not effective in processing high-dimensional data. In this paper, we propose a fast region query algorithm named fast principal component analysis pruning (called FPCAP) with the help of the fast principal component analysis technique in conjunction with geometric information provided by principal attributes of the data, which can process high-dimensional data and be easily applied to density-based methods to prune unnecessary distance calculations when finding neighbors and estimating densities. As an application in density-based clustering methods, FPCAP method was combined with the Density Based Spatial Clustering of Applications with Noise (DBSCAN) algorithm. And then, an improved DBSCAN (called IDBSCAN) is obtained, which preserves the advantage of DBSCAN and meanwhile, greatly reduces the computation of redundant distances. Experiments on seven benchmark datasets demonstrate that the proposed algorithm improves the computational efficiency significantly.

Data distortion is commonly applied in vision models during both training (e.g methods like MixUp and CutMix) and evaluation (e.g. shape-texture bias and robustness). This data modification can introduce artificial information. It is often assumed that the resulting artefacts are detrimental to training, whilst being negligible when analysing models. We investigate these assumptions and conclude that in some cases they are unfounded and lead to incorrect results. Specifically, we show current shape bias identification methods and occlusion robustness measures are biased and propose a fairer alternative for the latter. Subsequently, through a series of experiments we seek to correct and strengthen the community's perception of how augmenting affects learning of vision models. Based on our empirical results we argue that the impact of the artefacts must be understood and exploited rather than eliminated.

Online Real-Time Bidding (RTB) is a complex auction game among which advertisers struggle to bid for ad impressions when a user request occurs. Considering display cost, Return on Investment (ROI), and other influential Key Performance Indicators (KPIs), large ad platforms try to balance the trade-off among various goals in dynamics. To address the challenge, we propose a Multi-ObjecTive Actor-Critics algorithm based on reinforcement learning (RL), named MoTiAC, for the problem of bidding optimization with various goals. In MoTiAC, objective-specific agents update the global network asynchronously with different goals and perspectives, leading to a robust bidding policy. Unlike previous RL models, the proposed MoTiAC can simultaneously fulfill multi-objective tasks in complicated bidding environments. In addition, we mathematically prove that our model will converge to Pareto optimality. Finally, experiments on a large-scale real-world commercial dataset from Tencent verify the effectiveness of MoTiAC versus a set of recent approaches

Adversarial attacks on state-of-the-art machine learning models pose a significant threat to the safety and security of mission-critical autonomous systems. This paper considers the additional vulnerability of machine learning models when attackers can measure the power consumption of their underlying hardware platform. In particular, we explore the utility of power consumption information for adversarial attacks on non-volatile memory crossbar-based single-layer neural networks. Our results from experiments with MNIST and CIFAR-10 datasets show that power consumption can reveal important information about the neural network's weight matrix, such as the 1-norm of its columns. That information can be used to infer the sensitivity of the network's loss with respect to different inputs. We also find that surrogate-based black box attacks that utilize crossbar power information can lead to improved attack efficiency.

In this paper, we analyze the landscape of the true loss of neural networks with one hidden layer and ReLU, leaky ReLU, or quadratic activation. In all three cases, we provide a complete classification of the critical points in the case where the target function is affine and one-dimensional. In particular, we show that there exist no local maxima and clarify the structure of saddle points. Moreover, we prove that non-global local minima can only be caused by `dead' ReLU neurons. In particular, they do not appear in the case of leaky ReLU or quadratic activation. Our approach is of a combinatorial nature and builds on a careful analysis of the different types of hidden neurons that can occur.

Intelligence relies on an agent's knowledge of what it does not know. This capability can be assessed based on the quality of joint predictions of labels across multiple inputs. Conventional neural networks lack this capability and, since most research has focused on marginal predictions, this shortcoming has been largely overlooked. We introduce the epistemic neural network (ENN) as an interface for models that represent uncertainty as required to generate useful joint predictions. While prior approaches to uncertainty modeling such as Bayesian neural networks can be expressed as ENNs, this new interface facilitates comparison of joint predictions and the design of novel architectures and algorithms. In particular, we introduce the epinet: an architecture that can supplement any conventional neural network, including large pretrained models, and can be trained with modest incremental computation to estimate uncertainty. With an epinet, conventional neural networks outperform very large ensembles, consisting of hundreds or more particles, with orders of magnitude less computation. We demonstrate this efficacy across synthetic data, ImageNet, and some reinforcement learning tasks. As part of this effort we open-source experiment code.

Appropriately representing elements in a database so that queries may be accurately matched is a central task in information retrieval; recently, this has been achieved by embedding the graphical structure of the database into a manifold in a hierarchy-preserving manner using a variety of metrics. Persistent homology is a tool commonly used in topological data analysis that is able to rigorously characterize a database in terms of both its hierarchy and connectivity structure. Computing persistent homology on a variety of embedded datasets reveals that some commonly used embeddings fail to preserve the connectivity. We show that those embeddings which successfully retain the database topology coincide in persistent homology by introducing two dilation-invariant comparative measures to capture this effect: in particular, they address the issue of metric distortion on manifolds. We provide an algorithm for their computation that exhibits greatly reduced time complexity over existing methods. We use these measures to perform the first instance of topology-based information retrieval and demonstrate its increased performance over the standard bottleneck distance for persistent homology. We showcase our approach on databases of different data varieties including text, videos, and medical images.

Most existing neural architecture search (NAS) benchmarks and algorithms prioritize well-studied tasks, e.g. image classification on CIFAR or ImageNet. This makes the performance of NAS approaches in more diverse areas poorly understood. In this paper, we present NAS-Bench-360, a benchmark suite to evaluate methods on domains beyond those traditionally studied in architecture search, and use it to address the following question: do state-of-the-art NAS methods perform well on diverse tasks? To construct the benchmark, we curate ten tasks spanning a diverse array of application domains, dataset sizes, problem dimensionalities, and learning objectives. Each task is carefully chosen to interoperate with modern CNN-based search methods while possibly being far-afield from its original development domain. To speed up and reduce the cost of NAS research, for two of the tasks we release the precomputed performance of 15,625 architectures comprising a standard CNN search space. Experimentally, we show the need for more robust NAS evaluation of the kind NAS-Bench-360 enables by showing that several modern NAS procedures perform inconsistently across the ten tasks, with many catastrophically poor results. We also demonstrate how NAS-Bench-360 and its associated precomputed results will enable future scientific discoveries by testing whether several recent hypotheses promoted in the NAS literature hold on diverse tasks. NAS-Bench-360 is hosted at https://nb360.ml.cmu.edu.

Stuttering is a speech disorder during which the flow of speech is interrupted by involuntary pauses and repetition of sounds. Stuttering identification is an interesting interdisciplinary domain research problem which involves pathology, psychology, acoustics, and signal processing that makes it hard and complicated to detect. Recent developments in machine and deep learning have dramatically revolutionized speech domain, however minimal attention has been given to stuttering identification. This work fills the gap by trying to bring researchers together from interdisciplinary fields. In this paper, we review comprehensively acoustic features, statistical and deep learning based stuttering/disfluency classification methods. We also present several challenges and possible future directions.

When dealing with tabular data, models based on regression and decision trees are a popular choice due to the high accuracy they provide on such tasks and their ease of application as compared to other model classes. Yet, when it comes to graph-structure data, current tree learning algorithms do not provide tools to manage the structure of the data other than relying on feature engineering. In this work we address the above gap, and introduce Graph Trees with Attention (GTA), a new family of tree-based learning algorithms that are designed to operate on graphs. GTA leverages both the graph structure and the features at the vertices and employs an attention mechanism that allows decisions to concentrate on sub-structures of the graph. We analyze GTA models and show that they are strictly more expressive than plain decision trees. We also demonstrate the benefits of GTA empirically on multiple graph and node prediction benchmarks. In these experiments, GTA always outperformed other tree-based models and often outperformed other types of graph-learning algorithms such as Graph Neural Networks (GNNs) and Graph Kernels. Finally, we also provide an explainability mechanism for GTA, and demonstrate it can provide intuitive explanations.

Conformalized quantile regression is a procedure that inherits the advantages of conformal prediction and quantile regression. That is, we use quantile regression to estimate the true conditional quantile and then apply a conformal step on a calibration set to ensure marginal coverage. In this way, we get adaptive prediction intervals that account for heteroscedasticity. However, the aforementioned conformal step lacks adaptiveness as described in (Romano et al., 2019). To overcome this limitation, instead of applying a single conformal step after estimating conditional quantiles with quantile regression, we propose to cluster the explanatory variables weighted by their permutation importance with an optimized k-means and apply k conformal steps. To show that this improved version outperforms the classic version of conformalized quantile regression and is more adaptive to heteroscedasticity, we extensively compare the prediction intervals of both in open datasets.

Using task-specific components within a neural network in continual learning (CL) is a compelling strategy to address the stability-plasticity dilemma in fixed-capacity models without access to past data. Current methods focus only on selecting a sub-network for a new task that reduces forgetting of past tasks. However, this selection could limit the forward transfer of relevant past knowledge that helps in future learning. Our study reveals that satisfying both objectives jointly is more challenging when a unified classifier is used for all classes of seen tasks-class-Incremental Learning (class-IL)-as it is prone to ambiguities between classes across tasks. Moreover, the challenge increases when the semantic similarity of classes across tasks increases. To address this challenge, we propose a new CL method, named AFAF, that aims to Avoid Forgetting and Allow Forward transfer in class-IL using fix-capacity models. AFAF allocates a sub-network that enables selective transfer of relevant knowledge to a new task while preserving past knowledge, reusing some of the previously allocated components to utilize the fixed-capacity, and addressing class-ambiguities when similarities exist. The experiments show the effectiveness of AFAF in providing models with multiple CL desirable properties, while outperforming state-of-the-art methods on various challenging benchmarks with different semantic similarities.

Machine prediction algorithms (e.g., binary classifiers) often are adopted on the basis of claimed performance using classic metrics such as sensitivity and predictive value. However, classifier performance depends heavily upon the context (workflow) in which the classifier operates. Classic metrics do not reflect the realized utility of a predictor unless certain implicit assumptions are met, and these assumptions cannot be met in many common clinical scenarios. This often results in suboptimal implementations and in disappointment when expected outcomes are not achieved. One common failure mode for classic metrics arises when multiple predictions can be made for the same event, particularly when redundant true positive predictions produce little additional value. This describes many clinical alerting systems. We explain why classic metrics cannot correctly represent predictor performance in such contexts, and introduce an improved performance assessment technique using utility functions to score predictions based on their utility in a specific workflow context. The resulting utility metrics (u-metrics) explicitly account for the effects of temporal relationships on prediction utility. Compared to traditional measures, u-metrics more accurately reflect the real world costs and benefits of a predictor operating in a live clinical context. The improvement can be significant. We also describe a formal approach to snoozing, a mitigation strategy in which some predictions are suppressed to improve predictor performance by reducing false positives while retaining event capture. Snoozing is especially useful for predictors that generate interruptive alarms. U-metrics correctly measure and predict the performance benefits of snoozing, whereas traditional metrics do not.

While significant progress has been made on understanding hand-object interactions in computer vision, it is still very challenging for robots to perform complex dexterous manipulation. In this paper, we propose a new platform and pipeline DexMV (Dexterous Manipulation from Videos) for imitation learning. We design a platform with: (i) a simulation system for complex dexterous manipulation tasks with a multi-finger robot hand and (ii) a computer vision system to record large-scale demonstrations of a human hand conducting the same tasks. In our novel pipeline, we extract 3D hand and object poses from videos, and propose a novel demonstration translation method to convert human motion to robot demonstrations. We then apply and benchmark multiple imitation learning algorithms with the demonstrations. We show that the demonstrations can indeed improve robot learning by a large margin and solve the complex tasks which reinforcement learning alone cannot solve. More details can be found in the project page: https://yzqin.github.io/dexmv

Self-supervised learning (SSL) methods are enabling an increasing number of deep learning models to be trained on image datasets in domains where labels are difficult to obtain. These methods, however, struggle to scale to the high resolution of medical imaging datasets, where they are critical for achieving good generalization on label-scarce medical image datasets. In this work, we propose the Histopathology DatasetGAN (HDGAN) framework, an extension of the DatasetGAN semi-supervised framework for image generation and segmentation that scales well to large-resolution histopathology images. We make several adaptations from the original framework, including updating the generative backbone, selectively extracting latent features from the generator, and switching to memory-mapped arrays. These changes reduce the memory consumption of the framework, improving its applicability to medical imaging domains. We evaluate HDGAN on a thrombotic microangiopathy high-resolution tile dataset, demonstrating strong performance on the high-resolution image-annotation generation task. We hope that this work enables more application of deep learning models to medical datasets, in addition to encouraging more exploration of self-supervised frameworks within the medical imaging domain.

Recent advances in deep learning have relied on large, labelled datasets to train high-capacity models. However, collecting large datasets in a time- and cost-efficient manner often results in label noise. We present a method for learning from noisy labels that leverages similarities between training examples in feature space, encouraging the prediction of each example to be similar to its nearest neighbours. Compared to training algorithms that use multiple models or distinct stages, our approach takes the form of a simple, additional regularization term. It can be interpreted as an inductive version of the classical, transductive label propagation algorithm. We thoroughly evaluate our method on datasets evaluating both synthetic (CIFAR-10, CIFAR-100) and realistic (mini-WebVision, WebVision, Clothing1M, mini-ImageNet-Red) noise, and achieve competitive or state-of-the-art accuracies across all of them.

In this paper, a new gradient-based optimization approach by automatically adjusting the learning rate is proposed. This approach can be applied to design non-adaptive learning rate and adaptive learning rate. Firstly, I will introduce the non-adaptive learning rate optimization method: Binary Forward Exploration (BFE), and then the corresponding adaptive per-parameter learning rate method: Adaptive BFE (AdaBFE) is possible to be developed. This approach could be an alternative method to optimize the learning rate based on the stochastic gradient descent (SGD) algorithm besides the current non-adaptive learning rate methods e.g. SGD, momentum, Nesterov and the adaptive learning rate methods e.g. AdaGrad, AdaDelta, Adam... The purpose to develop this approach is not to beat the benchmark of other methods but just to provide a different perspective to optimize the gradient descent method, although some comparative study with previous methods will be made in the following sections. This approach is expected to be heuristic or inspire researchers to improve gradient-based optimization combined with previous methods.

As our ability to sense increases, we are experiencing a transition from data-poor problems, in which the central issue is a lack of relevant data, to data-rich problems, in which the central issue is to identify a few relevant features in a sea of observations. Motivated by applications in gravitational-wave astrophysics, we study the problem of predicting the presence of transient noise artifacts in a gravitational wave detector from a rich collection of measurements from the detector and its environment. We argue that feature learning--in which relevant features are optimized from data--is critical to achieving high accuracy. We introduce models that reduce the error rate by over 60% compared to the previous state of the art, which used fixed, hand-crafted features. Feature learning is useful not only because it improves performance on prediction tasks; the results provide valuable information about patterns associated with phenomena of interest that would otherwise be undiscoverable. In our application, features found to be associated with transient noise provide diagnostic information about its origin and suggest mitigation strategies. Learning in high-dimensional settings is challenging. Through experiments with a variety of architectures, we identify two key factors in successful models: sparsity, for selecting relevant variables within the high-dimensional observations; and depth, which confers flexibility for handling complex interactions and robustness with respect to temporal variations. We illustrate their significance through systematic experiments on real detector data. Our results provide experimental corroboration of common assumptions in the machine-learning community and have direct applicability to improving our ability to sense gravitational waves, as well as to many other problem settings with similarly high-dimensional, noisy, or partly irrelevant data.

The objective of Open set recognition (OSR) is to learn a classifier that can reject the unknown samples while classifying the known classes accurately. In this paper, we propose a self-supervision method, Detransformation Autoencoder (DTAE), for the OSR problem. This proposed method engages in learning representations that are invariant to the transformations of the input data. Experiments on several standard image datasets indicate that the pre-training process significantly improves the model performance in the OSR tasks. Meanwhile, our proposed self-supervision method achieves significant gains in detecting the unknown class and classifying the known classes. Moreover, our analysis indicates that DTAE can yield representations that contain more target class information and less transformation information than RotNet.

We introduce the Momentum Transformer, an attention-based deep learning architecture which outperforms benchmark momentum and mean-reversion trading strategies. Unlike state-of-the-art Long Short-Term Memory (LSTM) architectures, which are sequential in nature, the attention mechanism provides our architecture with a direct connection to all previous time-steps. Our architecture enables us to learn longer-term dependencies, improves performance when considering returns net of transaction costs and naturally adapts to new market regimes, such as during the SARS-CoV-2 crisis. The Momentum Transformer is inherently interpretable, providing us with greater insights into our deep learning momentum trading strategy, including how it blends different classical strategies and the past time-steps which are of the greatest significance to the model.

As engineered systems grow in complexity, there is an increasing need for automatic methods that can detect, diagnose, and even correct transient anomalies that inevitably arise and can be difficult or impossible to diagnose and fix manually. Among the most sensitive and complex systems of our civilization are the detectors that search for incredibly small variations in distance caused by gravitational waves -- phenomena originally predicted by Albert Einstein to emerge and propagate through the universe as the result of collisions between black holes and other massive objects in deep space. The extreme complexity and precision of such detectors causes them to be subject to transient noise issues that can significantly limit their sensitivity and effectiveness. In this work, we present a demonstration of a method that can detect and characterize emergent transient anomalies of such massively complex systems. We illustrate the performance, precision, and adaptability of the automated solution via one of the prevalent issues limiting gravitational-wave discoveries: noise artifacts of terrestrial origin that contaminate gravitational wave observatories' highly sensitive measurements and can obscure or even mimic the faint astrophysical signals for which they are listening. Specifically, we demonstrate how a highly interpretable convolutional classifier can automatically learn to detect transient anomalies from auxiliary detector data without needing to observe the anomalies themselves. We also illustrate several other useful features of the model, including how it performs automatic variable selection to reduce tens of thousands of auxiliary data channels to only a few relevant ones; how it identifies behavioral signatures predictive of anomalies in those channels; and how it can be used to investigate individual anomalies and the channels associated with them.

Normalizing flows are a class of deep generative models that provide a promising route to sample lattice field theories more efficiently than conventional Monte Carlo simulations. In this work we show that the theoretical framework of stochastic normalizing flows, in which neural-network layers are combined with Monte Carlo updates, is the same that underlies out-of-equilibrium simulations based on Jarzynski's equality, which have been recently deployed to compute free-energy differences in lattice gauge theories. We lay out a strategy to optimize the efficiency of this extended class of generative models and present examples of applications.

This article presents new hexagonal and pentagonal PEM fuel cell models. The models have been optimized after achieving improved cell performance. The input parameters of the multi-objective optimization algorithm were pressure and temperature at the inlet, and consumption and output powers were the objective parameters. The output data of the numerical simulation has been trained using deep neural networks and then modeled with polynomial regression. The target functions have been extracted using the RSM (Response Surface Method), and the targets were optimized using the multi-objective genetic algorithm (NSGA-II). Compared to the base model, the optimized Pentagonal and Hexagonal models increase the output current density by 21.8% and 39.9%, respectively.

In this work, we present CleanUNet, a causal speech denoising model on the raw waveform. The proposed model is based on an encoder-decoder architecture combined with several self-attention blocks to refine its bottleneck representations, which is crucial to obtain good results. The model is optimized through a set of losses defined over both waveform and multi-resolution spectrograms. The proposed method outperforms the state-of-the-art models in terms of denoised speech quality from various objective and subjective evaluation metrics.

In this paper we propose a Deep Learning architecture to approximate diffeomorphisms diffeotopic to the identity. We consider a control system of the form $\dot x = \sum_{i=1}^lF_i(x)u_i$, with linear dependence in the controls, and we use the corresponding flow to approximate the action of a diffeomorphism on a compact ensemble of points. Despite the simplicity of the control system, it has been recently shown that a Universal Approximation Property holds. The problem of minimizing the sum of the training error and of a regularizing term induces a gradient flow in the space of admissible controls. A possible training procedure for the discrete-time neural network consists in projecting the gradient flow onto a finite-dimensional subspace of the admissible controls. An alternative approach relies on an iterative method based on Pontryagin Maximum Principle for the numerical resolution of Optimal Control problems. Here the maximization of the Hamiltonian can be carried out with an extremely low computational effort, owing to the linear dependence of the system in the control variables.

Tensegrity robots, composed of rigid rods and flexible cables, are difficult to accurately model and control given the presence of complex dynamics and high number of DoFs. Differentiable physics engines have been recently proposed as a data-driven approach for model identification of such complex robotic systems. These engines are often executed at a high-frequency to achieve accurate simulation. Ground truth trajectories for training differentiable engines, however, are not typically available at such high frequencies due to limitations of real-world sensors. The present work focuses on this frequency mismatch, which impacts the modeling accuracy. We proposed a recurrent structure for a differentiable physics engine of tensegrity robots, which can be trained effectively even with low-frequency trajectories. To train this new recurrent engine in a robust way, this work introduces relative to prior work: (i) a new implicit integration scheme, (ii) a progressive training pipeline, and (iii) a differentiable collision checker. A model of NASA's icosahedron SUPERballBot on MuJoCo is used as the ground truth system to collect training data. Simulated experiments show that once the recurrent differentiable engine has been trained given the low-frequency trajectories from MuJoCo, it is able to match the behavior of MuJoCo's system. The criterion for success is whether a locomotion strategy learned using the differentiable engine can be transferred back to the ground-truth system and result in a similar motion. Notably, the amount of ground truth data needed to train the differentiable engine, such that the policy is transferable to the ground truth system, is 1% of the data needed to train the policy directly on the ground-truth system.

Deploying deep learning (DL) on mobile devices has been a notable trend in recent years. To support fast inference of on-device DL, DL libraries play a critical role as algorithms and hardware do. Unfortunately, no prior work ever dives deep into the ecosystem of modern DL libs and provides quantitative results on their performance. In this paper, we first build a comprehensive benchmark that includes 6 representative DL libs and 15 diversified DL models. We then perform extensive experiments on 10 mobile devices, which help reveal a complete landscape of the current mobile DL libs ecosystem. For example, we find that the best-performing DL lib is severely fragmented across different models and hardware, and the gap between those DL libs can be rather huge. In fact, the impacts of DL libs can overwhelm the optimizations from algorithms or hardware, e.g., model quantization and GPU/DSP-based heterogeneous computing. Finally, atop the observations, we summarize practical implications to different roles in the DL lib ecosystem.

Empirically observed time series in physics, biology, or medicine, are commonly generated by some underlying dynamical system (DS) which is the target of scientific interest. There is an increasing interest to harvest machine learning methods to reconstruct this latent DS in a data-driven, unsupervised way. In many areas of science it is common to sample time series observations from many data modalities simultaneously, e.g. electrophysiological and behavioral time series in a typical neuroscience experiment. However, current machine learning tools for reconstructing DSs usually focus on just one data modality. Here we propose a general framework for multi-modal data integration for the purpose of nonlinear DS reconstruction and the analysis of cross-modal relations. This framework is based on dynamically interpretable recurrent neural networks as general approximators of nonlinear DSs, coupled to sets of modality-specific decoder models from the class of generalized linear models. Both an expectation-maximization and a variational inference algorithm for model training are advanced and compared. We show on nonlinear DS benchmarks that our algorithms can efficiently compensate for too noisy or missing information in one data channel by exploiting other channels, and demonstrate on experimental neuroscience data how the algorithm learns to link different data domains to the underlying dynamics.

Deep learning-based facial recognition (FR) models have demonstrated state-of-the-art performance in the past few years, even when wearing protective medical face masks became commonplace during the COVID-19 pandemic. Given the outstanding performance of these models, the machine learning research community has shown increasing interest in challenging their robustness. Initially, researchers presented adversarial attacks in the digital domain, and later the attacks were transferred to the physical domain. However, in many cases, attacks in the physical domain are conspicuous, and thus may raise suspicion in real-world environments (e.g., airports). In this paper, we propose Adversarial Mask, a physical universal adversarial perturbation (UAP) against state-of-the-art FR models that is applied on face masks in the form of a carefully crafted pattern. In our experiments, we examined the transferability of our adversarial mask to a wide range of FR model architectures and datasets. In addition, we validated our adversarial mask's effectiveness in real-world experiments (CCTV use case) by printing the adversarial pattern on a fabric face mask. In these experiments, the FR system was only able to identify 3.34% of the participants wearing the mask (compared to a minimum of 83.34% with other evaluated masks). A demo of our experiments can be found at: https://youtu.be/_TXkDO5z11w.

Value-based reinforcement-learning algorithms have shown strong performances in games, robotics, and other real-world applications. The most popular sample-based method is $Q$-Learning. It subsequently performs updates by adjusting the current $Q$-estimate towards the observed reward and the maximum of the $Q$-estimates of the next state. The procedure introduces maximization bias with approaches like Double $Q$-Learning. We frame the bias problem statistically and consider it an instance of estimating the maximum expected value (MEV) of a set of random variables. We propose the $T$-Estimator (TE) based on two-sample testing for the mean, that flexibly interpolates between over- and underestimation by adjusting the significance level of the underlying hypothesis tests. A generalization, termed $K$-Estimator (KE), obeys the same bias and variance bounds as the TE while relying on a nearly arbitrary kernel function. We introduce modifications of $Q$-Learning and the Bootstrapped Deep $Q$-Network (BDQN) using the TE and the KE. Furthermore, we propose an adaptive variant of the TE-based BDQN that dynamically adjusts the significance level to minimize the absolute estimation bias. All proposed estimators and algorithms are thoroughly tested and validated on diverse tasks and environments, illustrating the bias control and performance potential of the TE and KE.

This paper presents a clustering technique that reduces the susceptibility to data noise by learning and clustering the data-distribution and then assigning the data to the cluster of its distribution and, in the process, reducing the impact of noise on clustering results. This method involves introducing a new distance among distributions, namely the expectation distance (denoted, ED), that goes beyond the state-of-art distribution distance of optimal mass transport (denoted, $W_2$ for $2$-Wasserstein): The latter essentially depends only on the marginal distributions while the former also employs the information about the joint distributions. Using the ED, the paper extends the classical $K$-means and $K$-medoids clustering to those over data-distributions (rather raw data) and introduces $K$-medoids using $W_2$. The paper also presents the closed-form expressions of the ED distance measure for the case when the uncertainty is Gaussian. The implementation results of the proposed ED and the $W_2$ distance measures to cluster real-world weather data are also presented, which involves efficiently extracting and using underlying uncertainty information in the form of means and variances (that, for example, is adequate to characterize Gaussian distributions). The results show striking performance improvement over classical clustering of raw data, with higher accuracy realized for ED. This is because while $W_2$ employs only the marginal distributions ignoring the correlations, the proposed ED also uses the joint distributions factoring the correlations into the distance measures.

Group equivariance (e.g. SE(3) equivariance) is a critical physical symmetry in science, from classical and quantum physics to computational biology. It enables robust and accurate prediction under arbitrary reference transformations. In light of this, great efforts have been put on encoding this symmetry into deep neural networks, which has been shown to improve the generalization performance and data efficiency for downstream tasks. Constructing an equivariant neural network generally brings high computational costs to ensure expressiveness. Therefore, how to better trade-off the expressiveness and computational efficiency plays a core role in the design of the equivariant deep learning models. In this paper, we propose a framework to construct SE(3) equivariant graph neural networks that can approximate the geometric quantities efficiently. Inspired by differential geometry and physics, we introduce equivariant local complete frames to graph neural networks, such that tensor information at given orders can be projected onto the frames. The local frame is constructed to form an orthonormal basis that avoids direction degeneration and ensure completeness. Since the frames are built only by cross product operations, our method is computationally efficient. We evaluate our method on two tasks: Newton mechanics modeling and equilibrium molecule conformation generation. Extensive experimental results demonstrate that our model achieves the best or competitive performance in two types of datasets.

In this article, we employ a collection of stochastic differential equations with drift and diffusion coefficients approximated by neural networks to predict the trend of chaotic time series which has big jump properties. Our contributions are, first, we propose a model called L\'evy induced stochastic differential equation network, which explores compounded stochastic differential equations with $\alpha$-stable L\'evy motion to model complex time series data and solve the problem through neural network approximation. Second, we theoretically prove the convergence of our algorithm with respect to hyper-parameters of the neural network, and obtain the error bound without curse of dimensionality. Finally, we illustrate our method by applying it to real financial time series data and find the accuracy increases through the use of non-Gaussian L\'evy processes. We also present detailed comparisons in terms of data patterns, various models, different shapes of L\'evy motion and the prediction lengths.

Machine learning models often encounter samples that are diverged from the training distribution. Failure to recognize an out-of-distribution (OOD) sample, and consequently assign that sample to an in-class label significantly compromises the reliability of a model. The problem has gained significant attention due to its importance for safety deploying models in open-world settings. Detecting OOD samples is challenging due to the intractability of modeling all possible unknown distributions. To date, several research domains tackle the problem of detecting unfamiliar samples, including anomaly detection, novelty detection, one-class learning, open set recognition, and out-of-distribution detection. Despite having similar and shared concepts, out-of-distribution, open-set, and anomaly detection have been investigated independently. Accordingly, these research avenues have not cross-pollinated, creating research barriers. While some surveys intend to provide an overview of these approaches, they seem to only focus on a specific domain without examining the relationship between different domains. This survey aims to provide a cross-domain and comprehensive review of numerous eminent works in respective areas while identifying their commonalities. Researchers can benefit from the overview of research advances in different fields and develop future methodology synergistically. Furthermore, to the best of our knowledge, while there are surveys in anomaly detection or one-class learning, there is no comprehensive or up-to-date survey on out-of-distribution detection, which our survey covers extensively. Finally, having a unified cross-domain perspective, we discuss and shed light on future lines of research, intending to bring these fields closer together.

Reinforcement learning has witnessed recent applications to a variety of tasks in quantum programming. The underlying assumption is that those tasks could be modeled as Markov Decision Processes (MDPs). Here, we investigate the feasibility of this assumption by exploring its consequences for two fundamental tasks in quantum programming: state preparation and gate compilation. By forming discrete MDPs, focusing exclusively on the single-qubit case (both with and without noise), we solve for the optimal policy exactly through policy iteration. We find optimal paths that correspond to the shortest possible sequence of gates to prepare a state, or compile a gate, up to some target accuracy. As an example, we find sequences of $H$ and $T$ gates with length as small as $11$ producing $\sim 99\%$ fidelity for states of the form $(HT)^{n} |0\rangle$ with values as large as $n=10^{10}$. In the presence of gate noise, we demonstrate how the optimal policy adapts to the effects of noisy gates in order to achieve a higher state fidelity. Our work shows that one can meaningfully impose a discrete, stochastic and Markovian nature to a continuous, deterministic and non-Markovian quantum evolution, and provides theoretical insight into why reinforcement learning may be successfully used to find optimally short gate sequences in quantum programming.

We introduce Astroconformer, a Transformer-based model to analyze stellar light curves from the Kepler mission. We demonstrate that Astrconformer can robustly infer the stellar surface gravity as a supervised task. Importantly, as Transformer captures long-range information in the time series, it outperforms the state-of-the-art data-driven method in the field, and the critical role of self-attention is proved through ablation experiments. Furthermore, the attention map from Astroconformer exemplifies the long-range correlation information learned by the model, leading to a more interpretable deep learning approach for asteroseismology. Besides data from Kepler, we also show that the method can generalize to sparse cadence light curves from the Rubin Observatory, paving the way for the new era of asteroseismology, harnessing information from long-cadence ground-based observations.

This article describes a system for analyzing acoustic data to assist in the diagnosis and classification of children's speech sound disorders (SSDs) using a computer. The analysis concentrated on identifying and categorizing four distinct types of Chinese SSDs. The study collected and generated a speech corpus containing 2540 stopping, backing, final consonant deletion process (FCDP), and affrication samples from 90 children aged 3--6 years with normal or pathological articulatory features. Each recording was accompanied by a detailed diagnostic annotation by two speech-language pathologists (SLPs). Classification of the speech samples was accomplished using three well-established neural network models for image classification. The feature maps were created using three sets of Mel-frequency cepstral coefficients (MFCC) parameters extracted from speech sounds and aggregated into a three-dimensional data structure as model input. We employed six techniques for data augmentation to augment the available dataset while avoiding overfitting. The experiments examine the usability of four different categories of Chinese phrases and characters. Experiments with different data subsets demonstrate the system's ability to accurately detect the analyzed pronunciation disorders. The best multi-class classification using a single Chinese phrase achieves an accuracy of 74.4~percent.

To preserve user privacy while enabling mobile intelligence, techniques have been proposed to train deep neural networks on decentralized data. However, training over decentralized data makes the design of neural architecture quite difficult as it already was. Such difficulty is further amplified when designing and deploying different neural architectures for heterogeneous mobile platforms. In this work, we propose an automatic neural architecture search into the decentralized training, as a new DNN training paradigm called Federated Neural Architecture Search, namely federated NAS. To deal with the primary challenge of limited on-client computational and communication resources, we present FedNAS, a highly optimized framework for efficient federated NAS. FedNAS fully exploits the key opportunity of insufficient model candidate re-training during the architecture search process, and incorporates three key optimizations: parallel candidates training on partial clients, early dropping candidates with inferior performance, and dynamic round numbers. Tested on large-scale datasets and typical CNN architectures, FedNAS achieves comparable model accuracy as state-of-the-art NAS algorithm that trains models with centralized data, and also reduces the client cost by up to two orders of magnitude compared to a straightforward design of federated NAS.

In applications of predictive modeling, such as insurance pricing, indirect or proxy discrimination is an issue of major concern. Namely, there exists the possibility that protected policyholder characteristics are implicitly inferred from non-protected ones by predictive models, and are thus having an undesirable (or illegal) impact on prices. A technical solution to this problem relies on building a best-estimate model using all policyholder characteristics (including protected ones) and then averaging out the protected characteristics for calculating individual prices. However, such approaches require full knowledge of policyholders' protected characteristics, which may in itself be problematic. Here, we address this issue by using a multi-task neural network architecture for claim predictions, which can be trained using only partial information on protected characteristics, and it produces prices that are free from proxy discrimination. We demonstrate the use of the proposed model and we find that its predictive accuracy is comparable to a conventional feedforward neural network (on full information). However, this multi-task network has clearly superior performance in the case of partially missing policyholder information.

We present a PAC-Bayes-style generalization bound which enables the replacement of the KL-divergence with a variety of Integral Probability Metrics (IPM). We provide instances of this bound with the IPM being the total variation metric and the Wasserstein distance. A notable feature of the obtained bounds is that they naturally interpolate between classical uniform convergence bounds in the worst case (when the prior and posterior are far away from each other), and preferable bounds in better cases (when the posterior and prior are close). This illustrates the possibility of reinforcing classical generalization bounds with algorithm- and data-dependent components, thus making them more suitable to analyze algorithms that use a large hypothesis space.

Heterogeneous graph neural networks (HGNNs) deliver the powerful capability to embed rich structural and semantic information of a heterogeneous graph into low-dimensional node representations. Existing HGNNs usually learn to embed information using hierarchy attention mechanism and repeated neighbor aggregation, suffering from unnecessary complexity and redundant computation. This paper proposes Simple and Efficient Heterogeneous Graph Neural Network (SeHGNN) which reduces this excess complexity through avoiding overused node-level attention within the same relation and pre-computing the neighbor aggregation in the pre-processing stage. Unlike previous work, SeHGNN utilizes a light-weight parameter-free neighbor aggregator to learn structural information for each metapath, and a transformer-based semantic aggregator to combine semantic information across metapaths for the final embedding of each node. As a result, SeHGNN offers the simple network structure, high prediction accuracy, and fast training speed. Extensive experiments on five real-world heterogeneous graphs demonstrate the superiority of SeHGNN over the state-of-the-arts on both the accuracy and training speed. Codes are available at https://github.com/ICT-GIMLab/SeHGNN.

Mathematical reasoning is one of the most impressive achievements of human intellect but remains a formidable challenge for artificial intelligence systems. In this work we explore whether modern deep learning architectures can learn to solve a symbolic addition task by discovering effective arithmetic procedures. Although the problem might seem trivial at first glance, generalizing arithmetic knowledge to operations involving a higher number of terms, possibly composed by longer sequences of digits, has proven extremely challenging for neural networks. Here we show that universal transformers equipped with local attention and adaptive halting mechanisms can learn to exploit an external, grid-like memory to carry out multi-digit addition. The proposed model achieves remarkable accuracy even when tested with problems requiring extrapolation outside the training distribution; most notably, it does so by discovering human-like calculation strategies such as place value alignment.

Binary classification with an imbalanced dataset is challenging. Models tend to consider all samples as belonging to the majority class. Although existing solutions such as sampling methods, cost-sensitive methods, and ensemble learning methods improve the poor accuracy of the minority class, these methods are limited by overfitting problems or cost parameters that are difficult to decide. We propose HADR, a hybrid approach with dimension reduction that consists of data block construction, dimentionality reduction, and ensemble learning with deep neural network classifiers. We evaluate the performance on eight imbalanced public datasets in terms of recall, G-mean, and AUC. The results show that our model outperforms state-of-the-art methods.

Heterogeneous networks, which connect informative nodes containing text with different edge types, are routinely used to store and process information in various real-world applications. Graph Neural Networks (GNNs) and their hyperbolic variants provide a promising approach to encode such networks in a low-dimensional latent space through neighborhood aggregation and hierarchical feature extraction, respectively. However, these approaches typically ignore metapath structures and the available semantic information. Furthermore, these approaches are sensitive to the noise present in the training data. To tackle these limitations, in this paper, we propose Text Enriched Sparse Hyperbolic Graph Convolution Network (TESH-GCN) to capture the graph's metapath structures using semantic signals and further improve prediction in large heterogeneous graphs. In TESH-GCN, we extract semantic node information, which successively acts as a connection signal to extract relevant nodes' local neighborhood and graph-level metapath features from the sparse adjacency tensor in a reformulated hyperbolic graph convolution layer. These extracted features in conjunction with semantic features from the language model (for robustness) are used for the final downstream task. Experiments on various heterogeneous graph datasets show that our model outperforms the current state-of-the-art approaches by a large margin on the task of link prediction. We also report a reduction in both the training time and model parameters compared to the existing hyperbolic approaches through a reformulated hyperbolic graph convolution. Furthermore, we illustrate the robustness of our model by experimenting with different levels of simulated noise in both the graph structure and text, and also, present a mechanism to explain TESH-GCN's prediction by analyzing the extracted metapaths.

Sustainability requires increased energy efficiency with minimal waste. The future power systems should thus provide high levels of flexibility iin controling energy consumption. Precise projections of future energy demand/load at the aggregate and on the individual site levels are of great importance for decision makers and professionals in the energy industry. Forecasting energy loads has become more advantageous for energy providers and customers, allowing them to establish an efficient production strategy to satisfy demand. This study introduces two hybrid cascaded models for forecasting multistep household power consumption in different resolutions. The first model integrates Stationary Wavelet Transform (SWT), as an efficient signal preprocessing technique, with Convolutional Neural Networks and Long Short Term Memory (LSTM). The second hybrid model combines SWT with a self-attention based neural network architecture named transformer. The major constraint of using time-frequency analysis methods such as SWT in multistep energy forecasting problems is that they require sequential signals, making signal reconstruction problematic in multistep forecasting applications.The cascaded models can efficiently address this problem through using the recursive outputs. Experimental results show that the proposed hybrid models achieve superior prediction performance compared to the existing multistep power consumption prediction methods. The results will pave the way for more accurate and reliable forecasting of household power consumption.

While much progress has been made in understanding the minimax sample complexity of reinforcement learning (RL) -- the complexity of learning on the "worst-case" instance -- such measures of complexity often do not capture the true difficulty of learning. In practice, on an "easy" instance, we might hope to achieve a complexity far better than that achievable on the worst-case instance. In this work we seek to understand the "instance-dependent" complexity of learning near-optimal policies (PAC RL) in the setting of RL with linear function approximation. We propose an algorithm, \textsc{Pedel}, which achieves a fine-grained instance-dependent measure of complexity, the first of its kind in the RL with function approximation setting, thereby capturing the difficulty of learning on each particular problem instance. Through an explicit example, we show that \textsc{Pedel} yields provable gains over low-regret, minimax-optimal algorithms and that such algorithms are unable to hit the instance-optimal rate. Our approach relies on a novel online experiment design-based procedure which focuses the exploration budget on the "directions" most relevant to learning a near-optimal policy, and may be of independent interest.

The manifold hypothesis is a core mechanism behind the success of deep learning, so understanding the intrinsic manifold structure of image data is central to studying how neural networks learn from the data. Intrinsic dataset manifolds and their relationship to learning difficulty have recently begun to be studied for the common domain of natural images, but little such research has been attempted for radiological images. We address this here. First, we compare the intrinsic manifold dimensionality of radiological and natural images. We also investigate the relationship between intrinsic dimensionality and generalization ability over a wide range of datasets. Our analysis shows that natural image datasets generally have a higher number of intrinsic dimensions than radiological images. However, the relationship between generalization ability and intrinsic dimensionality is much stronger for medical images, which could be explained as radiological images having intrinsic features that are more difficult to learn. These results give a more principled underpinning for the intuition that radiological images can be more challenging to apply deep learning to than natural image datasets common to machine learning research. We believe rather than directly applying models developed for natural images to the radiological imaging domain, more care should be taken to developing architectures and algorithms that are more tailored to the specific characteristics of this domain. The research shown in our paper, demonstrating these characteristics and the differences from natural images, is an important first step in this direction.

We show that standard Transformers without graph-specific modifications can lead to promising results in graph learning both in theory and practice. Given a graph, we simply treat all nodes and edges as independent tokens, augment them with token embeddings, and feed them to a Transformer. With an appropriate choice of token embeddings, we prove that this approach is theoretically at least as expressive as an invariant graph network (2-IGN) composed of equivariant linear layers, which is already more expressive than all message-passing Graph Neural Networks (GNN). When trained on a large-scale graph dataset (PCQM4Mv2), our method coined Tokenized Graph Transformer (TokenGT) achieves significantly better results compared to GNN baselines and competitive results compared to Transformer variants with sophisticated graph-specific inductive bias. Our implementation is available at https://github.com/jw9730/tokengt.

In the stochastic contextual bandit setting, regret-minimizing algorithms have been extensively researched, but their instance-minimizing best-arm identification counterparts remain seldom studied. In this work, we focus on the stochastic bandit problem in the $(\epsilon,\delta)$-$\textit{PAC}$ setting: given a policy class $\Pi$ the goal of the learner is to return a policy $\pi\in \Pi$ whose expected reward is within $\epsilon$ of the optimal policy with probability greater than $1-\delta$. We characterize the first $\textit{instance-dependent}$ PAC sample complexity of contextual bandits through a quantity $\rho_{\Pi}$, and provide matching upper and lower bounds in terms of $\rho_{\Pi}$ for the agnostic and linear contextual best-arm identification settings. We show that no algorithm can be simultaneously minimax-optimal for regret minimization and instance-dependent PAC for best-arm identification. Our main result is a new instance-optimal and computationally efficient algorithm that relies on a polynomial number of calls to an argmax oracle.

Masked image modeling (MIM) learns representations with remarkably good fine-tuning performances, overshadowing previous prevalent pre-training approaches such as image classification, instance contrastive learning, and image-text alignment. In this paper, we show that the inferior fine-tuning performance of these pre-training approaches can be significantly improved by a simple post-processing in the form of feature distillation (FD). The feature distillation converts the old representations to new representations that have a few desirable properties just like those representations produced by MIM. These properties, which we aggregately refer to as optimization friendliness, are identified and analyzed by a set of attention- and optimization-related diagnosis tools. With these properties, the new representations show strong fine-tuning performance. Specifically, the contrastive self-supervised learning methods are made as competitive in fine-tuning as the state-of-the-art masked image modeling (MIM) algorithms. The CLIP models' fine-tuning performance is also significantly improved, with a CLIP ViT-L model reaching \textbf{89.0%} top-1 accuracy on ImageNet-1K classification. On the 3-billion-parameter SwinV2-G model, the fine-tuning accuracy on ADE20K semantic segmentation is improved by +1.5 mIoU to \textbf{61.4 mIoU}, creating a new record. More importantly, our work provides a way for the future research to focus more effort on the generality and scalability of the learnt representations without being pre-occupied with optimization friendliness since it can be enhanced rather easily. The code will be available at https://github.com/SwinTransformer/Feature-Distillation.

Neural networks can be used to learn the solution of partial differential equations (PDEs) on arbitrary domains without requiring a computational mesh. Common approaches integrate differential operators in training neural networks using a structured loss function. The most common training algorithm for neural networks is backpropagation which relies on the gradient of the loss function with respect to the parameters of the network. In this work, we characterize the difficulty of training neural networks on physics by investigating the impact of differential operators in corrupting the back propagated gradients. Particularly, we show that perturbations present in the output of a neural network model during early stages of training lead to higher levels of noise in a structured loss function that is composed of high-order differential operators. These perturbations consequently corrupt the back-propagated gradients and impede convergence. We mitigate this issue by introducing auxiliary flux parameters to obtain a system of first-order differential equations. We formulate a non-linear unconstrained optimization problem using the augmented Lagrangian method that properly constrains the boundary conditions and adaptively focus on regions of higher gradients that are difficult to learn. We apply our approach to learn the solution of various benchmark PDE problems and demonstrate orders of magnitude improvement over existing approaches.

The statistical properties of the density map (DM) approach to counting microbiological objects on images are studied in detail. The DM is given by U$^2$-Net. Two statistical methods for deep neural networks are utilized: the bootstrap and the Monte Carlo (MC) dropout. The detailed analysis of the uncertainties for the DM predictions leads to a deeper understanding of the DM model's deficiencies. Based on our investigation, we propose a self-normalization module in the network. The improved network model, called \textit{Self-Normalized Density Map} (SNDM), can correct its output density map by itself to accurately predict the total number of objects in the image. The SNDM architecture outperforms the original model. Moreover, both statistical frameworks -- bootstrap and MC dropout -- have consistent statistical results for SNDM, which were not observed in the original model. The SNDM efficiency is comparable with the detector-base models, such as Faster and Cascade R-CNN detectors.

Graph neural networks (GNNs) provide powerful insights for brain neuroimaging technology from the view of graphical networks. However, most existing GNN-based models assume that the neuroimaging-produced brain connectome network is a homogeneous graph with single types of nodes and edges. In fact, emerging studies have reported and emphasized the significance of heterogeneity among human brain activities, especially between the two cerebral hemispheres. Thus, homogeneous-structured brain network-based graph methods are insufficient for modelling complicated cerebral activity states. To overcome this problem, in this paper, we present a heterogeneous graph neural network (HeBrainGNN) for multimodal brain neuroimaging fusion learning. We first model the brain network as a heterogeneous graph with multitype nodes (i.e., left and right hemispheric nodes) and multitype edges (i.e., intra- and interhemispheric edges). Then, we propose a self-supervised pretraining strategy based on a heterogeneous brain network to address the potential overfitting problem caused by the conflict between a large parameter size and a small medical data sample size. Our results show the superiority of the proposed model over other existing methods in brain-related disease prediction tasks. Ablation experiments show that our heterogeneous graph-based model attaches more importance to hemishpheric connections that may be neglected due to their low strength by previous homogeneous graph models. Other experiments also indicate that our proposed model with a pretraining strategy alleviates the problem of limited labelled data and yields a significant improvement in accuracy.

Camera Image Signal Processing(ISP) pipelines, including deep learning trained versions, can get appealing results in different image signal processing tasks. However, most if not all of these methods tend to apply a single filter that is homogeneous over the entire image. This is also particularly true when an encoder-decoder type deep architecture is trained for the task. However, it is natural to view a camera image as heterogeneous, as the color intensity and the artificial noise are distributed vastly different, even across the two dimensional domain of a single image. Varied Moire ringing, motion-blur, color-bleaching or lens based projection distortions can all potentially lead to a heterogeneous image artifact filtering problem. In this paper, we present a specific patch-based, local subspace deep neural network that improves Camera ISP to be robust to heterogeneous artifacts (especially image denoising). We call our three-fold deep trained model the Patch Subspace Learning Autoencoder (PSL-AE). PSL-AE does not necessarily assume uniform image distortion levels nor repeated nor similar artifact types within the image. Rather, PSL-AE first diagnostically encodes patches extracted from noisy and clean image pairs, with different artifact type and distortion levels, by contrastive learning. Then, each image's patches are encoded into soft-clusters in their appropriate latent sub-space, using a prior mixture model. Lastly, the decoders of the PSL-AE are also trained in an unsupervised manner customized for the image patches in each soft-cluster. Our experimental results demonstrates the flexibility and performance that one can achieve through improved heterogeneous filtering, both from synthesized artifacts but also realistic SIDD image pairs.

We aim to improve the performance of regressing hand keypoints and segmenting pixel-level hand masks under new imaging conditions (e.g., outdoors) when we only have labeled images taken under very different conditions (e.g., indoors). In the real world, it is important that the model trained for both tasks works under various imaging conditions. However, their variation covered by existing labeled hand datasets is limited. Thus, it is necessary to adapt the model trained on the labeled images (source) to unlabeled images (target) with unseen imaging conditions. While self-training domain adaptation methods (i.e., learning from the unlabeled target images in a self-supervised manner) have been developed for both tasks, their training may degrade performance when the predictions on the target images are noisy. To avoid this, it is crucial to assign a low importance (confidence) weight to the noisy predictions during self-training. In this paper, we propose to utilize the divergence of two predictions to estimate the confidence of the target image for both tasks. These predictions are given from two separate networks, and their divergence helps identify the noisy predictions. To integrate our proposed confidence estimation into self-training, we propose a teacher-student framework where the two networks (teachers) provide supervision to a network (student) for self-training, and the teachers are learned from the student by knowledge distillation. Our experiments show its superiority over state-of-the-art methods in adaptation settings with different lighting, grasping objects, backgrounds, and camera viewpoints. Our method improves by 4% the multi-task score on HO3D compared to the latest adversarial adaptation method. We also validate our method on Ego4D, egocentric videos with rapid changes in imaging conditions outdoors.

Although Reinforcement Learning (RL) is effective for sequential decision-making problems under uncertainty, it still fails to thrive in real-world systems where risk or safety is a binding constraint. In this paper, we formulate the RL problem with safety constraints as a non-zero-sum game. While deployed with maximum entropy RL, this formulation leads to a safe adversarially guided soft actor-critic framework, called SAAC. In SAAC, the adversary aims to break the safety constraint while the RL agent aims to maximize the constrained value function given the adversary's policy. The safety constraint on the agent's value function manifests only as a repulsion term between the agent's and the adversary's policies. Unlike previous approaches, SAAC can address different safety criteria such as safe exploration, mean-variance risk sensitivity, and CVaR-like coherent risk sensitivity. We illustrate the design of the adversary for these constraints. Then, in each of these variations, we show the agent differentiates itself from the adversary's unsafe actions in addition to learning to solve the task. Finally, for challenging continuous control tasks, we demonstrate that SAAC achieves faster convergence, better efficiency, and fewer failures to satisfy the safety constraints than risk-averse distributional RL and risk-neutral soft actor-critic algorithms.

Kidney transplantation can significantly enhance living standards for people suffering from end-stage renal disease. A significant factor that affects graft survival time (the time until the transplant fails and the patient requires another transplant) for kidney transplantation is the compatibility of the Human Leukocyte Antigens (HLAs) between the donor and recipient. In this paper, we propose 4 new biologically-relevant feature representations for incorporating HLA information into machine learning-based survival analysis algorithms. We evaluate our proposed HLA feature representations on a database of over 100,000 transplants and find that they improve prediction accuracy by about 1%, modest at the patient level but potentially significant at a societal level. Accurate prediction of survival times can improve transplant survival outcomes, enabling better allocation of donors to recipients and reducing the number of re-transplants due to graft failure with poorly matched donors.

This paper introduces a novel approach to embed flow-based models with hierarchical structures. The proposed framework is named Variational Flow Graphical (VFG) Model. VFGs learn the representation of high dimensional data via a message-passing scheme by integrating flow-based functions through variational inference. By leveraging the expressive power of neural networks, VFGs produce a representation of the data using a lower dimension, thus overcoming the drawbacks of many flow-based models, usually requiring a high dimensional latent space involving many trivial variables. Aggregation nodes are introduced in the VFG models to integrate forward-backward hierarchical information via a message passing scheme. Maximizing the evidence lower bound (ELBO) of data likelihood aligns the forward and backward messages in each aggregation node achieving a consistency node state. Algorithms have been developed to learn model parameters through gradient updating regarding the ELBO objective. The consistency of aggregation nodes enable VFGs to be applicable in tractable inference on graphical structures. Besides representation learning and numerical inference, VFGs provide a new approach for distribution modeling on datasets with graphical latent structures. Additionally, theoretical study shows that VFGs are universal approximators by leveraging the implicitly invertible flow-based structures. With flexible graphical structures and superior excessive power, VFGs could potentially be used to improve probabilistic inference. In the experiments, VFGs achieves improved evidence lower bound (ELBO) and likelihood values on multiple datasets.

Uncertainty quantification is a key component of machine learning models targeted at safety-critical systems such as in healthcare or autonomous vehicles. We study this problem in the context of meta learning, where the goal is to quickly adapt a predictor to new tasks. In particular, we propose a novel algorithm to construct \emph{PAC prediction sets}, which capture uncertainty via sets of labels, that can be adapted to new tasks with only a few training examples. These prediction sets satisfy an extension of the typical PAC guarantee to the meta learning setting; in particular, the PAC guarantee holds with high probability over future tasks. We demonstrate the efficacy of our approach on four datasets across three application domains: mini-ImageNet and CIFAR10-C in the visual domain, FewRel in the language domain, and the CDC Heart Dataset in the medical domain. In particular, our prediction sets satisfy the PAC guarantee while having smaller size compared to other baselines that also satisfy this guarantee.

Energy harvesting (EH) IoT devices that operate intermittently without batteries, coupled with advances in deep neural networks (DNNs), have opened up new opportunities for enabling sustainable smart applications. Nevertheless, implementing those computation and memory-intensive intelligent algorithms on EH devices is extremely difficult due to the challenges of limited resources and intermittent power supply that causes frequent failures. To address those challenges, this paper proposes a methodology that enables fast deep learning with low-energy accelerators for tiny energy harvesting devices. We first propose $RAD$, a resource-aware structured DNN training framework, which employs block circulant matrix and structured pruning to achieve high compression for leveraging the advantage of various vector operation accelerators. A DNN implementation method, $ACE$, is then proposed that employs low-energy accelerators to profit maximum performance with small energy consumption. Finally, we further design $FLEX$, the system support for intermittent computation in energy harvesting situations. Experimental results from three different DNN models demonstrate that $RAD$, $ACE$, and $FLEX$ can enable fast and correct inference on energy harvesting devices with up to 4.26X runtime reduction, up to 7.7X energy reduction with higher accuracy over the state-of-the-art.

Sparse decision tree optimization has been one of the most fundamental problems in AI since its inception and is a challenge at the core of interpretable machine learning. Sparse decision tree optimization is computationally hard, and despite steady effort since the 1960's, breakthroughs have only been made on the problem within the past few years, primarily on the problem of finding optimal sparse decision trees. However, current state-of-the-art algorithms often require impractical amounts of computation time and memory to find optimal or near-optimal trees for some real-world datasets, particularly those having several continuous-valued features. Given that the search spaces of these decision tree optimization problems are massive, can we practically hope to find a sparse decision tree that competes in accuracy with a black box machine learning model? We address this problem via smart guessing strategies that can be applied to any optimal branch-and-bound-based decision tree algorithm. We show that by using these guesses, we can reduce the run time by multiple orders of magnitude, while providing bounds on how far the resulting trees can deviate from the black box's accuracy and expressive power. Our approach enables guesses about how to bin continuous features, the size of the tree, and lower bounds on the error for the optimal decision tree. Our experiments show that in many cases we can rapidly construct sparse decision trees that match the accuracy of black box models. To summarize: when you are having trouble optimizing, just guess.

Online optimization is a well-established optimization paradigm that aims to make a sequence of correct decisions given knowledge of the correct answer to previous decision tasks. Bilevel programming involves a hierarchical optimization problem where the feasible region of the so-called outer problem is restricted by the graph of the solution set mapping of the inner problem. This paper brings these two ideas together and studies an online bilevel optimization setting in which a sequence of time-varying bilevel problems are revealed one after the other. We extend the known regret bounds for single-level online algorithms to the bilevel setting. Specifically, we introduce new notions of bilevel regret, develop an online alternating time-averaged gradient method that is capable of leveraging smoothness, and provide regret bounds in terms of the path-length of the inner and outer minimizer sequences.

Quantitative ultrasound, e.g., speed-of-sound (SoS) in tissues, provides information about tissue properties that have diagnostic value. Recent studies showed the possibility of extracting SoS information from pulse-echo ultrasound raw data (a.k.a. RF data) using deep neural networks that are fully trained on simulated data. These methods take sensor domain data, i.e., RF data, as input and train a network in an end-to-end fashion to learn the implicit mapping between the RF data domain and SoS domain. However, such networks are prone to overfitting to simulated data which results in poor performance and instability when tested on measured data. We propose a novel method for SoS mapping employing learned representations from two linked autoencoders. We test our approach on simulated and measured data acquired from human breast mimicking phantoms. We show that SoS mapping is possible using linked autoencoders. The proposed method has a Mean Absolute Percentage Error (MAPE) of 2.39% on the simulated data. On the measured data, the predictions of the proposed method are close to the expected values with MAPE of 1.1%. Compared to an end-to-end trained network, the proposed method shows higher stability and reproducibility.

Diffusion MRI tractography is an advanced imaging technique for quantitative mapping of the brain's structural connectivity. Whole brain tractography (WBT) data contains over hundreds of thousands of individual fiber streamlines (estimated brain connections), and this data is usually parcellated to create compact representations for data analysis applications such as disease classification. In this paper, we propose a novel parcellation-free WBT analysis framework, TractoFormer, that leverages tractography information at the level of individual fiber streamlines and provides a natural mechanism for interpretation of results using the attention mechanism of transformers. TractoFormer includes two main contributions. First, we propose a novel and simple 2D image representation of WBT, TractoEmbedding, to encode 3D fiber spatial relationships and any feature of interest that can be computed from individual fibers (such as FA or MD). Second, we design a network based on vision transformers (ViTs) that includes: 1) data augmentation to overcome model overfitting on small datasets, 2) identification of discriminative fibers for interpretation of results, and 3) ensemble learning to leverage fiber information from different brain regions. In a synthetic data experiment, TractoFormer successfully identifies discriminative fibers with simulated group differences. In a disease classification experiment comparing several methods, TractoFormer achieves the highest accuracy in classifying schizophrenia vs control. Discriminative fibers are identified in left hemispheric frontal and parietal superficial white matter regions, which have previously been shown to be affected in schizophrenia patients.

Ordinal regression with anchored reference samples (ORARS) has been proposed for predicting the subjective Mean Opinion Score (MOS) of input stimuli automatically. The ORARS addresses the MOS prediction problem by pairing a test sample with each of the pre-scored anchored reference samples. A trained binary classifier is then used to predict which sample, test or anchor, is better statistically. Posteriors of the binary preference decision are then used to predict the MOS of the test sample. In this paper, rigorous framework, analysis, and experiments to demonstrate that ORARS are advantageous over simple regressions are presented. The contributions of this work are: 1) Show that traditional regression can be reformulated into multiple preference tests to yield a better performance, which is confirmed with simulations experimentally; 2) Generalize ORARS to other regression problems and verify its effectiveness; 3) Provide some prerequisite conditions which can insure proper application of ORARS.

Many modern sequential recommender systems use deep neural networks, which can effectively estimate the relevance of items but require a lot of time to train. Slow training increases expenses, hinders product development timescales and prevents the model from being regularly updated to adapt to changing user preferences. Training such sequential models involves appropriately sampling past user interactions to create a realistic training objective. The existing training objectives have limitations. For instance, next item prediction never uses the beginning of the sequence as a learning target, thereby potentially discarding valuable data. On the other hand, the item masking used by BERT4Rec is only weakly related to the goal of the sequential recommendation; therefore, it requires much more time to obtain an effective model. Hence, we propose a novel Recency-based Sampling of Sequences training objective that addresses both limitations. We apply our method to various recent and state-of-the-art model architectures - such as GRU4Rec, Caser, and SASRec. We show that the models enhanced with our method can achieve performances exceeding or very close to stateof-the-art BERT4Rec, but with much less training time.

In many scientific disciplines, we are interested in inferring the nonlinear dynamical system underlying a set of observed time series, a challenging task in the face of chaotic behavior and noise. Previous deep learning approaches toward this goal often suffered from a lack of interpretability and tractability. In particular, the high-dimensional latent spaces often required for a faithful embedding, even when the underlying dynamics lives on a lower-dimensional manifold, can hamper theoretical analysis. Motivated by the emerging principles of dendritic computation, we augment a dynamically interpretable and mathematically tractable piecewise-linear (PL) recurrent neural network (RNN) by a linear spline basis expansion. We show that this approach retains all the theoretically appealing properties of the simple PLRNN, yet boosts its capacity for approximating arbitrary nonlinear dynamical systems in comparatively low dimensions. We employ two frameworks for training the system, one combining back-propagation-through-time (BPTT) with teacher forcing, and another based on fast and scalable variational inference. We show that the dendritically expanded PLRNN achieves better reconstructions with fewer parameters and dimensions on various dynamical systems benchmarks and compares favorably to other methods, while retaining a tractable and interpretable structure.

Healthcare datasets often contain groups of highly correlated features, such as features from the same biological system. When feature selection is applied to these datasets to identify the most important features, the biases inherent in some multivariate feature selectors due to correlated features make it difficult for these methods to distinguish between the important and irrelevant features and the results of the feature selection process can be unstable. Feature selection ensembles, which aggregate the results of multiple individual base feature selectors, have been investigated as a means of stabilising feature selection results, but do not address the problem of correlated features. We present a novel framework to create feature selection ensembles from multivariate feature selectors while taking into account the biases produced by groups of correlated features, using agglomerative hierarchical clustering in a pre-processing step. These methods were applied to two real-world datasets from studies of Alzheimer's disease (AD), a progressive neurodegenerative disease that has no cure and is not yet fully understood. Our results show a marked improvement in the stability of features selected over the models without clustering, and the features selected by these models are in keeping with the findings in the AD literature.

Named entity linking (NEL) in news is a challenging endeavour due to the frequency of unseen and emerging entities, which necessitates the use of unsupervised or zero-shot methods. However, such methods tend to come with caveats, such as no integration of suitable knowledge bases (like Wikidata) for emerging entities, a lack of scalability, and poor interpretability. Here, we consider person disambiguation in Quotebank, a massive corpus of speaker-attributed quotations from the news, and investigate the suitability of intuitive, lightweight, and scalable heuristics for NEL in web-scale corpora. Our best performing heuristic disambiguates 94% and 63% of the mentions on Quotebank and the AIDA-CoNLL benchmark, respectively. Additionally, the proposed heuristics compare favourably to the state-of-the-art unsupervised and zero-shot methods, Eigenthemes and mGENRE, respectively, thereby serving as strong baselines for unsupervised and zero-shot entity linking.

Physics-informed neural networks (PINNs) have emerged as a powerful tool for solving partial differential equations (PDEs) in a variety of domains. While previous research in PINNs has mainly focused on constructing and balancing loss functions during training to avoid poor minima, the effect of sampling collocation points on the performance of PINNs has largely been overlooked. In this work, we find that the performance of PINNs can vary significantly with different sampling strategies, and using a fixed set of collocation points can be quite detrimental to the convergence of PINNs to the correct solution. In particular, (1) we hypothesize that training of PINNs rely on successful "propagation" of solution from initial and/or boundary condition points to interior points, and PINNs with poor sampling strategies can get stuck at trivial solutions if there are \textit{propagation failures}. (2) We demonstrate that propagation failures are characterized by highly imbalanced PDE residual fields where very high residuals are observed over very narrow regions. (3) To mitigate propagation failure, we propose a novel \textit{evolutionary sampling} (Evo) method that can incrementally accumulate collocation points in regions of high PDE residuals. We further provide an extension of Evo to respect the principle of causality while solving time-dependent PDEs. We empirically demonstrate the efficacy and efficiency of our proposed methods in a variety of PDE problems.

Diversity of terrestrial plants plays a key role in maintaining a stable, healthy, and productive ecosystem. Though remote sensing has been seen as a promising and cost-effective proxy for estimating plant diversity, there is a lack of quantitative studies on how confidently plant diversity can be inferred from spaceborne hyperspectral data. In this study, we assessed the ability of hyperspectral data captured by the DLR Earth Sensing Imaging Spectrometer (DESIS) for estimating plant species richness in the Southern Tablelands and Snowy Mountains regions in southeast Australia. Spectral features were firstly extracted from DESIS spectra with principal component analysis, canonical correlation analysis, and partial least squares analysis. Then regression was conducted between the extracted features and plant species richness with ordinary least squares regression, kernel ridge regression, and Gaussian process regression. Results were assessed with the coefficient of correlation ($r$) and Root-Mean-Square Error (RMSE), based on a two-fold cross validation scheme. With the best performing model, $r$ is 0.71 and RMSE is 5.99 for the Southern Tablelands region, while $r$ is 0.62 and RMSE is 6.20 for the Snowy Mountains region. The assessment results reported in this study provide supports for future studies on understanding the relationship between spaceborne hyperspectral measurements and terrestrial plant biodiversity.

Unsupervised distribution alignment estimates a transformation that maps two or more source distributions to a shared aligned distribution given only samples from each distribution. This task has many applications including generative modeling, unsupervised domain adaptation, and socially aware learning. Most prior works use adversarial learning (i.e., min-max optimization), which can be challenging to optimize and evaluate. A few recent works explore non-adversarial flow-based (i.e., invertible) approaches, but they lack a unified perspective and are limited in efficiently aligning multiple distributions. Therefore, we propose to unify and generalize previous flow-based approaches under a single non-adversarial framework, which we prove is equivalent to minimizing an upper bound on the Jensen-Shannon Divergence (JSD). Importantly, our problem reduces to a min-min, i.e., cooperative, problem and can provide a natural evaluation metric for unsupervised distribution alignment. We present empirical results of our framework on both simulated and real-world datasets to demonstrate the benefits of our approach.

Echo state network (ESN), a kind of recurrent neural networks, consists of a fixed reservoir in which neurons are connected randomly and recursively and obtains the desired output only by training output connection weights. First-order reduced and controlled error (FORCE) learning is an online supervised training approach that can change the chaotic activity of ESNs into specified activity patterns. This paper proposes a composite FORCE learning method based on recursive least squares to train ESNs whose initial activity is spontaneously chaotic, where a composite learning technique featured by dynamic regressor extension and memory data exploitation is applied to enhance parameter convergence. The proposed method is applied to a benchmark problem about predicting chaotic time series generated by the Mackey-Glass system, and numerical results have shown that it significantly improves learning and prediction performances compared with existing methods.

Consider the following optimization problem: Given $n \times n$ matrices $A$ and $\Lambda$, maximize $\langle A, U\Lambda U^*\rangle$ where $U$ varies over the unitary group $\mathrm{U}(n)$. This problem seeks to approximate $A$ by a matrix whose spectrum is the same as $\Lambda$ and, by setting $\Lambda$ to be appropriate diagonal matrices, one can recover matrix approximation problems such as PCA and rank-$k$ approximation. We study the problem of designing differentially private algorithms for this optimization problem in settings where the matrix $A$ is constructed using users' private data. We give efficient and private algorithms that come with upper and lower bounds on the approximation error. Our results unify and improve upon several prior works on private matrix approximation problems. They rely on extensions of packing/covering number bounds for Grassmannians to unitary orbits which should be of independent interest.

Machine learning (ML) models are typically optimized for their accuracy on a given dataset. However, this predictive criterion rarely captures all desirable properties of a model, in particular how well it matches a domain expert's understanding of a task. Underspecification refers to the existence of multiple models that are indistinguishable in their in-domain accuracy, even though they differ in other desirable properties such as out-of-distribution (OOD) performance. Identifying these situations is critical for assessing the reliability of ML models. We formalize the concept of underspecification and propose a method to identify and partially address it. We train multiple models with an independence constraint that forces them to implement different functions. They discover predictive features that are otherwise ignored by standard empirical risk minimization (ERM), which we then distill into a global model with superior OOD performance. Importantly, we constrain the models to align with the data manifold to ensure that they discover meaningful features. We demonstrate the method on multiple datasets in computer vision (collages, WILDS-Camelyon17, GQA) and discuss general implications of underspecification. Most notably, in-domain performance cannot serve for OOD model selection without additional assumptions.  ( 2 min )

Graph theoretical analyses have become standard tools in modeling functional and anatomical connectivity in the brain. With the advent of connectomics, the primary graphs or networks of interest are structural connectome (derived from DTI tractography) and functional connectome (derived from resting-state fMRI). However, most published connectome studies have focused on either structural or functional connectome, yet complementary information between them, when available in the same dataset, can be jointly leveraged to improve our understanding of the brain. To this end, we propose a function-constrained structural graph variational autoencoder (FCS-GVAE) capable of incorporating information from both functional and structural connectome in an unsupervised fashion. This leads to a joint low-dimensional embedding that establishes a unified spatial coordinate system for comparing across different subjects. We evaluate our approach using the publicly available OASIS-3 Alzheimer's disease (AD) dataset and show that a variational formulation is necessary to optimally encode functional brain dynamics. Further, the proposed joint embedding approach can more accurately distinguish different patient sub-populations than approaches that do not use complementary connectome information.  ( 2 min )

In our comprehensive experiments and evaluations, we show that it is possible to generate multiple contrast (even all synthetically) and use synthetically generated images to train an image segmentation engine. We showed promising segmentation results tested on real multi-contrast MRI scans when delineating muscle, fat, bone and bone marrow, all trained on synthetic images. Based on synthetic image training, our segmentation results were as high as 93.91\%, 94.11\%, 91.63\%, 95.33\%, for muscle, fat, bone, and bone marrow delineation, respectively. Results were not significantly different from the ones obtained when real images were used for segmentation training: 94.68\%, 94.67\%, 95.91\%, and 96.82\%, respectively.  ( 2 min )

The observation that stochastic gradient descent (SGD) favors flat minima has played a fundamental role in understanding implicit regularization of SGD and guiding the tuning of hyperparameters. In this paper, we provide a quantitative explanation of this striking phenomenon by relating the particular noise structure of SGD to its \emph{linear stability} (Wu et al., 2018). Specifically, we consider training over-parameterized models with square loss. We prove that if a global minimum $\theta^*$ is linearly stable for SGD, then it must satisfy $\|H(\theta^*)\|_F\leq O(\sqrt{B}/\eta)$, where $\|H(\theta^*)\|_F, B,\eta$ denote the Frobenius norm of Hessian at $\theta^*$, batch size, and learning rate, respectively. Otherwise, SGD will escape from that minimum \emph{exponentially} fast. Hence, for minima accessible to SGD, the flatness -- as measured by the Frobenius norm of the Hessian -- is bounded independently of the model size and sample size. The key to obtaining these results is exploiting the particular geometry awareness of SGD noise: 1) the noise magnitude is proportional to loss value; 2) the noise directions concentrate in the sharp directions of local landscape. This property of SGD noise provably holds for linear networks and random feature models (RFMs) and is empirically verified for nonlinear networks. Moreover, the validity and practical relevance of our theoretical findings are justified by extensive numerical experiments.  ( 3 min )

We provide a study of how induced model sparsity can help achieve compositional generalization and better sample efficiency in grounded language learning problems. We consider simple language-conditioned navigation problems in a grid world environment with disentangled observations. We show that standard neural architectures do not always yield compositional generalization. To address this, we design an agent that contains a goal identification module that encourages sparse correlations between words in the instruction and attributes of objects, composing them together to find the goal. The output of the goal identification module is the input to a value iteration network planner. Our agent maintains a high level of performance on goals containing novel combinations of properties even when learning from a handful of demonstrations. We examine the internal representations of our agent and find the correct correspondences between words in its dictionary and attributes in the environment.  ( 2 min )

Speech coding facilitates the transmission of speech over low-bandwidth networks with minimal distortion. Neural-network based speech codecs have recently demonstrated significant improvements in quality over traditional approaches. While this new generation of codecs is capable of synthesizing high-fidelity speech, their use of recurrent or convolutional layers often restricts their effective receptive fields, which prevents them from compressing speech efficiently. We propose to further reduce the bitrate of neural speech codecs through the use of pretrained Transformers, capable of exploiting long-range dependencies in the input signal due to their inductive bias. As such, we use a pretrained Transformer in tandem with a convolutional encoder, which is trained end-to-end with a quantizer and a generative adversarial net decoder. Our numerical experiments show that supplementing the convolutional encoder of a neural speech codec with Transformer speech embeddings yields a speech codec with a bitrate of $600\,\mathrm{bps}$ that outperforms the original neural speech codec in synthesized speech quality when trained at the same bitrate. Subjective human evaluations suggest that the quality of the resulting codec is comparable or better than that of conventional codecs operating at three to four times the rate.  ( 2 min )

Relationships in scientific data, such as the numerical and spatial distribution relations of features in univariate data, the scalar-value combinations' relations in multivariate data, and the association of volumes in time-varying and ensemble data, are intricate and complex. This paper presents voxel2vec, a novel unsupervised representation learning model, which is used to learn distributed representations of scalar values/scalar-value combinations in a low-dimensional vector space. Its basic assumption is that if two scalar values/scalar-value combinations have similar contexts, they usually have high similarity in terms of features. By representing scalar values/scalar-value combinations as symbols, voxel2vec learns the similarity between them in the context of spatial distribution and then allows us to explore the overall association between volumes by transfer prediction. We demonstrate the usefulness and effectiveness of voxel2vec by comparing it with the isosurface similarity map of univariate data and applying the learned distributed representations to feature classification for multivariate data and to association analysis for time-varying and ensemble data.  ( 2 min )

In order to be applicable in real-world scenario, Boundary Attacks (BAs) were proposed and ensured one hundred percent attack success rate with only decision information. However, existing BA methods craft adversarial examples by leveraging a simple random sampling (SRS) to estimate the gradient, consuming a large number of model queries. To overcome the drawback of SRS, this paper proposes a Latin Hypercube Sampling based Boundary Attack (LHS-BA) to save query budget. Compared with SRS, LHS has better uniformity under the same limited number of random samples. Therefore, the average on these random samples is closer to the true gradient than that estimated by SRS. Various experiments are conducted on benchmark datasets including MNIST, CIFAR, and ImageNet-1K. Experimental results demonstrate the superiority of the proposed LHS-BA over the state-of-the-art BA methods in terms of query efficiency. The source codes are publicly available at https://github.com/GZHU-DVL/LHS-BA.  ( 2 min )

Artificial intelligence, and particularly machine learning (ML), is increasingly developed and deployed to support healthcare in a variety of settings. However, clinical decision support (CDS) technologies based on ML need to be portable if they are to be adopted on a broad scale. In this respect, models developed at one institution should be reusable at another. Yet there are numerous examples of portability failure, particularly due to naive application of ML models. Portability failure can lead to suboptimal care and medical errors, which ultimately could prevent the adoption of ML-based CDS in practice. One specific healthcare challenge that could benefit from enhanced portability is the prediction of 30-day readmission risk. Research to date has shown that deep learning models can be effective at modeling such risk. In this work, we investigate the practicality of model portability through a cross-site evaluation of readmission prediction models. To do so, we apply a recurrent neural network, augmented with self-attention and blended with expert features, to build readmission prediction models for two independent large scale claims datasets. We further present a novel transfer learning technique that adapts the well-known method of born-again network (BAN) training. Our experiments show that direct application of ML models trained at one institution and tested at another institution perform worse than models trained and tested at the same institution. We further show that the transfer learning approach based on the BAN produces models that are better than those trained on just a single institution's data. Notably, this improvement is consistent across both sites and occurs after a single retraining, which illustrates the potential for a cheap and general model transfer mechanism of readmission risk prediction.  ( 3 min )

We provide a detailed evaluation of various image classification architectures (convolutional, vision transformer, and fully connected MLP networks) and data augmentation techniques towards generalization to large spacial translation shifts. We make the following observations: (a) In the absence of data augmentation, all architectures, including convolutional networks suffer degradation in performance when evaluated on translated test distributions. Understandably, both the in-distribution accuracy as well as degradation to shifts is significantly worse for non-convolutional architectures. (b) Across all architectures, even a minimal augmentation of $4$ pixel random crop improves the robustness of performance to much larger magnitude shifts of up to $1/4$ of image size ($8$-$16$ pixels) in the test data -- suggesting a form of meta generalization from augmentation. For non-convolutional architectures, while the absolute accuracy is still low, we see dramatic improvements in robustness to large translation shifts. (c) With sufficiently advanced augmentation ($4$ pixel crop+RandAugmentation+Erasing+MixUp) pipeline all architectures can be trained to have competitive performance, both in terms of in-distribution accuracy as well as generalization to large translation shifts.  ( 2 min )

The regulatory approval and broad clinical deployment of medical AI have been hampered by the perception that deep learning models fail in unpredictable and possibly catastrophic ways. A lack of statistically rigorous uncertainty quantification is a significant factor undermining trust in AI results. Recent developments in distribution-free uncertainty quantification present practical solutions for these issues by providing reliability guarantees for black-box models on arbitrary data distributions as formally valid finite-sample prediction intervals. Our work applies these new uncertainty quantification methods -- specifically conformal prediction -- to a deep-learning model for grading the severity of spinal stenosis in lumbar spine MRI. We demonstrate a technique for forming ordinal prediction sets that are guaranteed to contain the correct stenosis severity within a user-defined probability (confidence interval). On a dataset of 409 MRI exams processed by the deep-learning model, the conformal method provides tight coverage with small prediction set sizes. Furthermore, we explore the potential clinical applicability of flagging cases with high uncertainty predictions (large prediction sets) by quantifying an increase in the prevalence of significant imaging abnormalities (e.g. motion artifacts, metallic artifacts, and tumors) that could degrade confidence in predictive performance when compared to a random sample of cases.  ( 2 min )

While neural networks demonstrate a remarkable ability to model linguistic content, capturing contextual information related to a speaker's conversational role is an open area of research. In this work, we analyze the effect of speaker role on language use through the game of Mafia, in which participants are assigned either an honest or a deceptive role. In addition to building a framework to collect a dataset of Mafia game records, we demonstrate that there are differences in the language produced by players with different roles. We confirm that classification models are able to rank deceptive players as more suspicious than honest ones based only on their use of language. Furthermore, we show that training models on two auxiliary tasks outperforms a standard BERT-based text classification approach. We also present methods for using our trained models to identify features that distinguish between player roles, which could be used to assist players during the Mafia game.  ( 2 min )

We approximated the evaluation function for the game Tic-Tac-Toe by singular value decomposition (SVD) and investigated the effect of approximation accuracy on winning rate. We first prepared the perfect evaluation function of Tic-Tac-Toe and performed low-rank approximation by considering the evaluation function as a ninth-order tensor. We found that we can reduce the amount of information of the evaluation function by 70% without significantly degrading the performance. Approximation accuracy and winning rate were strongly correlated but not perfectly proportional. We also investigated how the decomposition method of the evaluation function affects the performance. We considered two decomposition methods: simple SVD regarding the evaluation function as a matrix and the Tucker decomposition by higher-order SVD (HOSVD). At the same compression ratio, the strategy with the approximated evaluation function obtained by HOSVD exhibited a significantly higher winning rate than that obtained by SVD. These results suggest that SVD can effectively compress board game strategies and an optimal compression method that depends on the game exists.  ( 2 min )

Born Machines are quantum-inspired generative models that leverage the probabilistic nature of quantum states. Here, we present a new architecture called many-body localized (MBL) hidden Born machine that uses both MBL dynamics and hidden units as learning resources. We theoretically prove that MBL Born machines possess more expressive power than classical models, and the introduction of hidden units boosts its learning power. We numerically demonstrate that the MBL hidden Born machine is capable of learning a toy dataset consisting of patterns of MNIST handwritten digits, quantum data obtained from quantum many-body states, and non-local parity data. In order to understand the mechanism behind learning, we track physical quantities such as von Neumann entanglement entropy and Hamming distance during learning, and compare the learning outcomes in the MBL, thermal, and Anderson localized phases. We show that the superior learning power of the MBL phase relies importantly on both localization and interaction. Our architecture and algorithm provide novel strategies of utilizing quantum many-body systems as learning resources, and reveal a powerful connection between disorder, interaction, and learning in quantum systems.  ( 2 min )

Semi-supervised learning (SSL) is one of the dominant approaches to address the annotation bottleneck of supervised learning. Recent SSL methods can effectively leverage a large repository of unlabeled data to improve performance while relying on a small set of labeled data. One common assumption in most SSL methods is that the labeled and unlabeled data are from the same underlying data distribution. However, this is hardly the case in many real-world scenarios, which limits their applicability. In this work, instead, we attempt to solve the recently proposed challenging open-world SSL problem that does not make such an assumption. In the open-world SSL problem, the objective is to recognize samples of known classes, and simultaneously detect and cluster samples belonging to novel classes present in unlabeled data. This work introduces OpenLDN that utilizes a pairwise similarity loss to discover novel classes. Using a bi-level optimization rule this pairwise similarity loss exploits the information available in the labeled set to implicitly cluster novel class samples, while simultaneously recognizing samples from known classes. After discovering novel classes, OpenLDN transforms the open-world SSL problem into a standard SSL problem to achieve additional performance gains using existing SSL methods. Our extensive experiments demonstrate that OpenLDN outperforms the current state-of-the-art methods on multiple popular classification benchmarks while providing a better accuracy/training time trade-off.  ( 3 min )

The existing work in cross-view geo-localization is based on images where a ground panorama is matched to an aerial image. In this work, we focus on ground videos instead of images which provides additional contextual cues which are important for this task. There are no existing datasets for this problem, therefore we propose GAMa dataset, a large-scale dataset with ground videos and corresponding aerial images. We also propose a novel approach to solve this problem. At clip-level, a short video clip is matched with corresponding aerial image and is later used to get video-level geo-localization of a long video. Moreover, we propose a hierarchical approach to further improve the clip-level geolocalization. It is a challenging dataset, unaligned and limited field of view, and our proposed method achieves a Top-1 recall rate of 19.4% and 45.1% @1.0mile. Code and dataset are available at following link: https://github.com/svyas23/GAMa.  ( 2 min )

{G}{ustav} Fechner's 1860 delineation of psychophysics, the measurement of sensation in relation to its stimulus, is widely considered to be the advent of modern psychological science. In psychophysics, a researcher parametrically varies some aspects of a stimulus, and measures the resulting changes in a human subject's experience of that stimulus; doing so gives insight to the determining relationship between a sensation and the physical input that evoked it. This approach is used heavily in perceptual domains, including signal detection, threshold measurement, and ideal observer analysis. Scientific fields like vision science have always leaned heavily on the methods and procedures of psychophysics, but there is now growing appreciation of them by machine learning researchers, sparked by widening overlap between biological and artificial perception \cite{rojas2011automatic, scheirer2014perceptual,escalera2014chalearn,zhang2018agil, grieggs2021measuring}. Machine perception that is guided by behavioral measurements, as opposed to guidance restricted to arbitrarily assigned human labels, has significant potential to fuel further progress in artificial intelligence.  ( 2 min )

Some events which happen in the future could be important for companies, governments, and even our personal life. Prediction of these events before their establishment is helpful for efficient decision-making. We call such events emerging entities. They have not taken place yet, and there is no information about them in KB. However, some clues exist in different areas, especially on social media. Thus, retrieving these type of entities are possible. This paper proposes a method of early discovery of emerging entities. We use semantic clustering of short messages. To evaluate the performance of our proposal, we devise and utilize a performance evaluation metric. The results show that our proposed method finds those emerging entities of which Twitter trends are not always capable.  ( 2 min )

High-throughput experimentation with autonomous workflows, increasingly used to screen and optimize optoelectronic thin films, requires matching throughput of downstream characterizations. Despite being essential, thickness characterization lags in throughput. Although optical spectroscopic methods, e.g., spectrophotometry, provide quick measurements, a critical bottleneck is the ensuing manual fitting of optical oscillation models to the measured reflection and transmission. This study presents a machine-learning (ML) framework called thicknessML, which rapidly extracts film thickness from spectroscopic reflection and transmission. thicknessML leverages transfer learning to generalize to materials of different underlying optical oscillator models (i.e., different material classes).We demonstrate that thicknessML can extract film thickness from six perovskite samples in a two-stage process: (1) pre-training on a generic simulated dataset of Tauc-Lorentz oscillator, and (2) transfer learning to a simulated perovskite dataset of several literature perovskite refractive indices. Results show a pre-training thickness mean absolute percentage error (MAPE) of 5-7% and an experimental thickness MAPE of 6-19%.  ( 2 min )

Successful deployment of multi-agent reinforcement learning often requires agents to adapt their behaviour. In this work, we discuss the problem of teamwork adaptation in which a team of agents needs to adapt their policies to solve novel tasks with limited fine-tuning. Motivated by the intuition that agents need to be able to identify and distinguish tasks in order to adapt their behaviour to the current task, we propose to learn multi-agent task embeddings (MATE). These task embeddings are trained using an encoder-decoder architecture optimised for reconstruction of the transition and reward functions which uniquely identify tasks. We show that a team of agents is able to adapt to novel tasks when provided with task embeddings. We propose three MATE training paradigms: independent MATE, centralised MATE, and mixed MATE which vary in the information used for the task encoding. We show that the embeddings learned by MATE identify tasks and provide useful information which agents leverage during adaptation to novel tasks.  ( 2 min )

It has been shown (Amuru et al. 2015) that online learning algorithms can be effectively used to select optimal physical layer parameters for jamming against digital modulation schemes without a priori knowledge of the victim's transmission strategy. However, this learning problem involves solving a multi-armed bandit problem with a mixed action space that can grow very large. As a result, convergence to the optimal jamming strategy can be slow, especially when the victim and jammer's symbols are not perfectly synchronized. In this work, we remedy the sample efficiency issues by introducing a linear bandit algorithm that accounts for inherent similarities between actions. Further, we propose context features which are well-suited for the statistical features of the non-coherent jamming problem and demonstrate significantly improved convergence behavior compared to the prior art. Additionally, we show how prior knowledge about the victim's transmissions can be seamlessly integrated into the learning framework. We finally discuss limitations in the asymptotic regime.  ( 2 min )

Early detection of retinal diseases is one of the most important means of preventing partial or permanent blindness in patients. In this research, a novel multi-label classification system is proposed for the detection of multiple retinal diseases, using fundus images collected from a variety of sources. First, a new multi-label retinal disease dataset, the MuReD dataset, is constructed, using a number of publicly available datasets for fundus disease classification. Next, a sequence of post-processing steps is applied to ensure the quality of the image data and the range of diseases, present in the dataset. For the first time in fundus multi-label disease classification, a transformer-based model optimized through extensive experimentation is used for image analysis and decision making. Numerous experiments are performed to optimize the configuration of the proposed system. It is shown that the approach performs better than state-of-the-art works on the same task by 7.9% and 8.1% in terms of AUC score for disease detection and disease classification, respectively. The obtained results further support the potential applications of transformer-based architectures in the medical imaging field.  ( 3 min )

Table Question Answering (TQA) is an important but under-explored task. Most of the existing QA datasets are in unstructured text format and only few of them use tables as the context. To the best of our knowledge, none of TQA datasets exist in the biomedical domain where tables are frequently used to present information. In this paper, we first curate a table question answering dataset, BioTABQA, using 22 templates and the context from a biomedical textbook on differential diagnosis. BioTABQA can not only be used to teach a model how to answer questions from tables but also evaluate how a model generalizes to unseen questions, an important scenario for biomedical applications. To achieve the generalization evaluation, we divide the templates into 17 training and 5 cross-task evaluations. Then, we develop two baselines using single and multi-tasks learning on BioTABQA. Furthermore, we explore instructional learning, a recent technique showing impressive generalizing performance. Experimental results show that our instruction-tuned model outperforms single and multi-task baselines on an average by ~23% and ~6% across various evaluation settings, and more importantly, instruction-tuned model outperforms baselines by ~5% on cross-tasks.  ( 2 min )

The advent of federated learning has facilitated large-scale data exchange amongst machine learning models while maintaining privacy. Despite its brief history, federated learning is rapidly evolving to make wider use more practical. One of the most significant advancements in this domain is the incorporation of transfer learning into federated learning, which overcomes fundamental constraints of primary federated learning, particularly in terms of security. This chapter performs a comprehensive survey on the intersection of federated and transfer learning from a security point of view. The main goal of this study is to uncover potential vulnerabilities and defense mechanisms that might compromise the privacy and performance of systems that use federated and transfer learning.  ( 2 min )

Deep learning is pushing the state-of-the-art in many computer vision applications. However, it relies on large annotated data repositories, and capturing the unconstrained nature of the real-world data is yet to be solved. Semi-supervised learning (SSL) complements the annotated training data with a large corpus of unlabeled data to reduce annotation cost. The standard SSL approach assumes unlabeled data are from the same distribution as annotated data. Recently, ORCA [9] introduce a more realistic SSL problem, called open-world SSL, by assuming that the unannotated data might contain samples from unknown classes. This work proposes a novel approach to tackle SSL in open-world setting, where we simultaneously learn to classify known and unknown classes. At the core of our method, we utilize sample uncertainty and incorporate prior knowledge about class distribution to generate reliable pseudo-labels for unlabeled data belonging to both known and unknown classes. Our extensive experimentation showcases the effectiveness of our approach on several benchmark datasets, where it substantially outperforms the existing state-of-the-art on seven diverse datasets including CIFAR-100 (17.6%), ImageNet-100 (5.7%), and Tiny ImageNet (9.9%).  ( 2 min )

Fast MRI aims to reconstruct a high fidelity image from partially observed measurements. Exuberant development in fast MRI using deep learning has been witnessed recently. Meanwhile, novel deep learning paradigms, e.g., Transformer based models, are fast-growing in natural language processing and promptly developed for computer vision and medical image analysis due to their prominent performance. Nevertheless, due to the complexity of the Transformer, the application of fast MRI may not be straightforward. The main obstacle is the computational cost of the self-attention layer, which is the core part of the Transformer, can be expensive for high resolution MRI inputs. In this study, we propose a new Transformer architecture for solving fast MRI that coupled Shifted Windows Transformer with U-Net to reduce the network complexity. We incorporate deformable attention to construe the explainability of our reconstruction model. We empirically demonstrate that our method achieves consistently superior performance on the fast MRI task. Besides, compared to state-of-the-art Transformer models, our method has fewer network parameters while revealing explainability. The code is publicly available at https://github.com/ayanglab/SDAUT.  ( 2 min )

Every home is different, and every person likes things done in their particular way. Therefore, home robots of the future need to both reason about the sequential nature of day-to-day tasks and generalize to user's preferences. To this end, we propose a Transformer Task Planner(TTP) that learns high-level actions from demonstrations by leveraging object attribute-based representations. TTP can be pre-trained on multiple preferences and shows generalization to unseen preferences using a single demonstration as a prompt in a simulated dishwasher loading task. Further, we demonstrate real-world dish rearrangement using TTP with a Franka Panda robotic arm, prompted using a single human demonstration.  ( 2 min )

We consider resource management problems in multi-user wireless networks, which can be cast as optimizing a network-wide utility function, subject to constraints on the long-term average performance of users across the network. We propose a state-augmented algorithm for solving the aforementioned radio resource management (RRM) problems, where, alongside the instantaneous network state, the RRM policy takes as input the set of dual variables corresponding to the constraints, which evolve depending on how much the constraints are violated during execution. We theoretically show that the proposed state-augmented algorithm leads to feasible and near-optimal RRM decisions. Moreover, focusing on the problem of wireless power control using graph neural network (GNN) parameterizations, we demonstrate the superiority of the proposed RRM algorithm over baseline methods across a suite of numerical experiments.  ( 2 min )

Normalizing flows are a class of deep generative models that provide a promising route to sample lattice field theories more efficiently than conventional Monte Carlo simulations. In this work we show that the theoretical framework of stochastic normalizing flows, in which neural-network layers are combined with Monte Carlo updates, is the same that underlies out-of-equilibrium simulations based on Jarzynski's equality, which have been recently deployed to compute free-energy differences in lattice gauge theories. We lay out a strategy to optimize the efficiency of this extended class of generative models and present examples of applications.

We present a novel approach to probabilistic electricity price forecasting (EPF) which utilizes distributional artificial neural networks. The novel network structure for EPF is based on a regularized distributional multilayer perceptron (DMLP) which contains a probability layer. Using the TensorFlow Probability framework, the neural network's output is defined to be a distribution, either normal or potentially skewed and heavy-tailed Johnson's SU (JSU). The method is compared against state-of-the-art benchmarks in a forecasting study. The study comprises forecasting involving day-ahead electricity prices in the German market. The results show evidence of the importance of higher moments when modeling electricity prices.

We consider resource management problems in multi-user wireless networks, which can be cast as optimizing a network-wide utility function, subject to constraints on the long-term average performance of users across the network. We propose a state-augmented algorithm for solving the aforementioned radio resource management (RRM) problems, where, alongside the instantaneous network state, the RRM policy takes as input the set of dual variables corresponding to the constraints, which evolve depending on how much the constraints are violated during execution. We theoretically show that the proposed state-augmented algorithm leads to feasible and near-optimal RRM decisions. Moreover, focusing on the problem of wireless power control using graph neural network (GNN) parameterizations, we demonstrate the superiority of the proposed RRM algorithm over baseline methods across a suite of numerical experiments.

We give a method for proactively identifying small, plausible shifts in distribution which lead to large differences in model performance. To ensure that these shifts are plausible, we parameterize them in terms of interpretable changes in causal mechanisms of observed variables. This defines a parametric robustness set of plausible distributions and a corresponding worst-case loss. While the loss under an individual parametric shift can be estimated via reweighting techniques such as importance sampling, the resulting worst-case optimization problem is non-convex, and the estimate may suffer from large variance. For small shifts, however, we can construct a local second-order approximation to the loss under shift and cast the problem of finding a worst-case shift as a particular non-convex quadratic optimization problem, for which efficient algorithms are available. We demonstrate that this second-order approximation can be estimated directly for shifts in conditional exponential family models, and we bound the approximation error. We apply our approach to a computer vision task (classifying gender from images), revealing sensitivity to shifts in non-causal attributes.

Intelligence relies on an agent's knowledge of what it does not know. This capability can be assessed based on the quality of joint predictions of labels across multiple inputs. Conventional neural networks lack this capability and, since most research has focused on marginal predictions, this shortcoming has been largely overlooked. We introduce the epistemic neural network (ENN) as an interface for models that represent uncertainty as required to generate useful joint predictions. While prior approaches to uncertainty modeling such as Bayesian neural networks can be expressed as ENNs, this new interface facilitates comparison of joint predictions and the design of novel architectures and algorithms. In particular, we introduce the epinet: an architecture that can supplement any conventional neural network, including large pretrained models, and can be trained with modest incremental computation to estimate uncertainty. With an epinet, conventional neural networks outperform very large ensembles, consisting of hundreds or more particles, with orders of magnitude less computation. We demonstrate this efficacy across synthetic data, ImageNet, and some reinforcement learning tasks. As part of this effort we open-source experiment code.

This paper introduces a novel approach to embed flow-based models with hierarchical structures. The proposed framework is named Variational Flow Graphical (VFG) Model. VFGs learn the representation of high dimensional data via a message-passing scheme by integrating flow-based functions through variational inference. By leveraging the expressive power of neural networks, VFGs produce a representation of the data using a lower dimension, thus overcoming the drawbacks of many flow-based models, usually requiring a high dimensional latent space involving many trivial variables. Aggregation nodes are introduced in the VFG models to integrate forward-backward hierarchical information via a message passing scheme. Maximizing the evidence lower bound (ELBO) of data likelihood aligns the forward and backward messages in each aggregation node achieving a consistency node state. Algorithms have been developed to learn model parameters through gradient updating regarding the ELBO objective. The consistency of aggregation nodes enable VFGs to be applicable in tractable inference on graphical structures. Besides representation learning and numerical inference, VFGs provide a new approach for distribution modeling on datasets with graphical latent structures. Additionally, theoretical study shows that VFGs are universal approximators by leveraging the implicitly invertible flow-based structures. With flexible graphical structures and superior excessive power, VFGs could potentially be used to improve probabilistic inference. In the experiments, VFGs achieves improved evidence lower bound (ELBO) and likelihood values on multiple datasets.

Conformalized quantile regression is a procedure that inherits the advantages of conformal prediction and quantile regression. That is, we use quantile regression to estimate the true conditional quantile and then apply a conformal step on a calibration set to ensure marginal coverage. In this way, we get adaptive prediction intervals that account for heteroscedasticity. However, the aforementioned conformal step lacks adaptiveness as described in (Romano et al., 2019). To overcome this limitation, instead of applying a single conformal step after estimating conditional quantiles with quantile regression, we propose to cluster the explanatory variables weighted by their permutation importance with an optimized k-means and apply k conformal steps. To show that this improved version outperforms the classic version of conformalized quantile regression and is more adaptive to heteroscedasticity, we extensively compare the prediction intervals of both in open datasets.

Appropriately representing elements in a database so that queries may be accurately matched is a central task in information retrieval; recently, this has been achieved by embedding the graphical structure of the database into a manifold in a hierarchy-preserving manner using a variety of metrics. Persistent homology is a tool commonly used in topological data analysis that is able to rigorously characterize a database in terms of both its hierarchy and connectivity structure. Computing persistent homology on a variety of embedded datasets reveals that some commonly used embeddings fail to preserve the connectivity. We show that those embeddings which successfully retain the database topology coincide in persistent homology by introducing two dilation-invariant comparative measures to capture this effect: in particular, they address the issue of metric distortion on manifolds. We provide an algorithm for their computation that exhibits greatly reduced time complexity over existing methods. We use these measures to perform the first instance of topology-based information retrieval and demonstrate its increased performance over the standard bottleneck distance for persistent homology. We showcase our approach on databases of different data varieties including text, videos, and medical images.

Astrophysical light curves are particularly challenging data objects due to the intensity and variety of noise contaminating them. Yet, despite the astronomical volumes of light curves available, the majority of algorithms used to process them are still operating on a per-sample basis. To remedy this, we propose a simple Transformer model -- called Denoising Time Series Transformer (DTST) -- and show that it excels at removing the noise and outliers in datasets of time series when trained with a masked objective, even when no clean targets are available. Moreover, the use of self-attention enables rich and illustrative queries into the learned representations. We present experiments on real stellar light curves from the Transiting Exoplanet Space Satellite (TESS), showing advantages of our approach compared to traditional denoising techniques.

While much progress has been made in understanding the minimax sample complexity of reinforcement learning (RL) -- the complexity of learning on the "worst-case" instance -- such measures of complexity often do not capture the true difficulty of learning. In practice, on an "easy" instance, we might hope to achieve a complexity far better than that achievable on the worst-case instance. In this work we seek to understand the "instance-dependent" complexity of learning near-optimal policies (PAC RL) in the setting of RL with linear function approximation. We propose an algorithm, \textsc{Pedel}, which achieves a fine-grained instance-dependent measure of complexity, the first of its kind in the RL with function approximation setting, thereby capturing the difficulty of learning on each particular problem instance. Through an explicit example, we show that \textsc{Pedel} yields provable gains over low-regret, minimax-optimal algorithms and that such algorithms are unable to hit the instance-optimal rate. Our approach relies on a novel online experiment design-based procedure which focuses the exploration budget on the "directions" most relevant to learning a near-optimal policy, and may be of independent interest.

Uncertainty quantification is a key component of machine learning models targeted at safety-critical systems such as in healthcare or autonomous vehicles. We study this problem in the context of meta learning, where the goal is to quickly adapt a predictor to new tasks. In particular, we propose a novel algorithm to construct \emph{PAC prediction sets}, which capture uncertainty via sets of labels, that can be adapted to new tasks with only a few training examples. These prediction sets satisfy an extension of the typical PAC guarantee to the meta learning setting; in particular, the PAC guarantee holds with high probability over future tasks. We demonstrate the efficacy of our approach on four datasets across three application domains: mini-ImageNet and CIFAR10-C in the visual domain, FewRel in the language domain, and the CDC Heart Dataset in the medical domain. In particular, our prediction sets satisfy the PAC guarantee while having smaller size compared to other baselines that also satisfy this guarantee.

The observation that stochastic gradient descent (SGD) favors flat minima has played a fundamental role in understanding implicit regularization of SGD and guiding the tuning of hyperparameters. In this paper, we provide a quantitative explanation of this striking phenomenon by relating the particular noise structure of SGD to its \emph{linear stability} (Wu et al., 2018). Specifically, we consider training over-parameterized models with square loss. We prove that if a global minimum $\theta^*$ is linearly stable for SGD, then it must satisfy $\|H(\theta^*)\|_F\leq O(\sqrt{B}/\eta)$, where $\|H(\theta^*)\|_F, B,\eta$ denote the Frobenius norm of Hessian at $\theta^*$, batch size, and learning rate, respectively. Otherwise, SGD will escape from that minimum \emph{exponentially} fast. Hence, for minima accessible to SGD, the flatness -- as measured by the Frobenius norm of the Hessian -- is bounded independently of the model size and sample size. The key to obtaining these results is exploiting the particular geometry awareness of SGD noise: 1) the noise magnitude is proportional to loss value; 2) the noise directions concentrate in the sharp directions of local landscape. This property of SGD noise provably holds for linear networks and random feature models (RFMs) and is empirically verified for nonlinear networks. Moreover, the validity and practical relevance of our theoretical findings are justified by extensive numerical experiments.

In this paper, we develop a general theory for adaptive nonparametric estimation of mean functions of nonstationary and nonlinear time series using deep neural networks (DNNs). We first consider two types of DNN estimators, non-penalized and sparse-penalized DNN estimators, and establish their generalization error bounds for general nonstationary time series. We then derive minimax lower bounds for estimating mean functions belonging to a wide class of nonlinear autoregressive (AR) models that include nonlinear generalized additive AR, single index, and threshold AR models. Building upon the results, we show that the sparse-penalized DNN estimator is adaptive and attains the minimax optimal rates up to a poly-logarithmic factor for many nonlinear AR models. Through numerical simulations, we demonstrate the usefulness of the DNN methods for estimating nonlinear AR models with intrinsic low-dimensional structures and discontinuous or rough mean functions, which is consistent with our theory.

In this article, we employ a collection of stochastic differential equations with drift and diffusion coefficients approximated by neural networks to predict the trend of chaotic time series which has big jump properties. Our contributions are, first, we propose a model called L\'evy induced stochastic differential equation network, which explores compounded stochastic differential equations with $\alpha$-stable L\'evy motion to model complex time series data and solve the problem through neural network approximation. Second, we theoretically prove the convergence of our algorithm with respect to hyper-parameters of the neural network, and obtain the error bound without curse of dimensionality. Finally, we illustrate our method by applying it to real financial time series data and find the accuracy increases through the use of non-Gaussian L\'evy processes. We also present detailed comparisons in terms of data patterns, various models, different shapes of L\'evy motion and the prediction lengths.

We introduce the Momentum Transformer, an attention-based deep learning architecture which outperforms benchmark momentum and mean-reversion trading strategies. Unlike state-of-the-art Long Short-Term Memory (LSTM) architectures, which are sequential in nature, the attention mechanism provides our architecture with a direct connection to all previous time-steps. Our architecture enables us to learn longer-term dependencies, improves performance when considering returns net of transaction costs and naturally adapts to new market regimes, such as during the SARS-CoV-2 crisis. The Momentum Transformer is inherently interpretable, providing us with greater insights into our deep learning momentum trading strategy, including how it blends different classical strategies and the past time-steps which are of the greatest significance to the model.

Consider the following optimization problem: Given $n \times n$ matrices $A$ and $\Lambda$, maximize $\langle A, U\Lambda U^*\rangle$ where $U$ varies over the unitary group $\mathrm{U}(n)$. This problem seeks to approximate $A$ by a matrix whose spectrum is the same as $\Lambda$ and, by setting $\Lambda$ to be appropriate diagonal matrices, one can recover matrix approximation problems such as PCA and rank-$k$ approximation. We study the problem of designing differentially private algorithms for this optimization problem in settings where the matrix $A$ is constructed using users' private data. We give efficient and private algorithms that come with upper and lower bounds on the approximation error. Our results unify and improve upon several prior works on private matrix approximation problems. They rely on extensions of packing/covering number bounds for Grassmannians to unitary orbits which should be of independent interest.

Empirically observed time series in physics, biology, or medicine, are commonly generated by some underlying dynamical system (DS) which is the target of scientific interest. There is an increasing interest to harvest machine learning methods to reconstruct this latent DS in a data-driven, unsupervised way. In many areas of science it is common to sample time series observations from many data modalities simultaneously, e.g. electrophysiological and behavioral time series in a typical neuroscience experiment. However, current machine learning tools for reconstructing DSs usually focus on just one data modality. Here we propose a general framework for multi-modal data integration for the purpose of nonlinear DS reconstruction and the analysis of cross-modal relations. This framework is based on dynamically interpretable recurrent neural networks as general approximators of nonlinear DSs, coupled to sets of modality-specific decoder models from the class of generalized linear models. Both an expectation-maximization and a variational inference algorithm for model training are advanced and compared. We show on nonlinear DS benchmarks that our algorithms can efficiently compensate for too noisy or missing information in one data channel by exploiting other channels, and demonstrate on experimental neuroscience data how the algorithm learns to link different data domains to the underlying dynamics.

Born Machines are quantum-inspired generative models that leverage the probabilistic nature of quantum states. Here, we present a new architecture called many-body localized (MBL) hidden Born machine that uses both MBL dynamics and hidden units as learning resources. We theoretically prove that MBL Born machines possess more expressive power than classical models, and the introduction of hidden units boosts its learning power. We numerically demonstrate that the MBL hidden Born machine is capable of learning a toy dataset consisting of patterns of MNIST handwritten digits, quantum data obtained from quantum many-body states, and non-local parity data. In order to understand the mechanism behind learning, we track physical quantities such as von Neumann entanglement entropy and Hamming distance during learning, and compare the learning outcomes in the MBL, thermal, and Anderson localized phases. We show that the superior learning power of the MBL phase relies importantly on both localization and interaction. Our architecture and algorithm provide novel strategies of utilizing quantum many-body systems as learning resources, and reveal a powerful connection between disorder, interaction, and learning in quantum systems.

It has been shown (Amuru et al. 2015) that online learning algorithms can be effectively used to select optimal physical layer parameters for jamming against digital modulation schemes without a priori knowledge of the victim's transmission strategy. However, this learning problem involves solving a multi-armed bandit problem with a mixed action space that can grow very large. As a result, convergence to the optimal jamming strategy can be slow, especially when the victim and jammer's symbols are not perfectly synchronized. In this work, we remedy the sample efficiency issues by introducing a linear bandit algorithm that accounts for inherent similarities between actions. Further, we propose context features which are well-suited for the statistical features of the non-coherent jamming problem and demonstrate significantly improved convergence behavior compared to the prior art. Additionally, we show how prior knowledge about the victim's transmissions can be seamlessly integrated into the learning framework. We finally discuss limitations in the asymptotic regime.

This paper presents a clustering technique that reduces the susceptibility to data noise by learning and clustering the data-distribution and then assigning the data to the cluster of its distribution and, in the process, reducing the impact of noise on clustering results. This method involves introducing a new distance among distributions, namely the expectation distance (denoted, ED), that goes beyond the state-of-art distribution distance of optimal mass transport (denoted, $W_2$ for $2$-Wasserstein): The latter essentially depends only on the marginal distributions while the former also employs the information about the joint distributions. Using the ED, the paper extends the classical $K$-means and $K$-medoids clustering to those over data-distributions (rather raw data) and introduces $K$-medoids using $W_2$. The paper also presents the closed-form expressions of the ED distance measure for the case when the uncertainty is Gaussian. The implementation results of the proposed ED and the $W_2$ distance measures to cluster real-world weather data are also presented, which involves efficiently extracting and using underlying uncertainty information in the form of means and variances (that, for example, is adequate to characterize Gaussian distributions). The results show striking performance improvement over classical clustering of raw data, with higher accuracy realized for ED. This is because while $W_2$ employs only the marginal distributions ignoring the correlations, the proposed ED also uses the joint distributions factoring the correlations into the distance measures.

We present a PAC-Bayes-style generalization bound which enables the replacement of the KL-divergence with a variety of Integral Probability Metrics (IPM). We provide instances of this bound with the IPM being the total variation metric and the Wasserstein distance. A notable feature of the obtained bounds is that they naturally interpolate between classical uniform convergence bounds in the worst case (when the prior and posterior are far away from each other), and preferable bounds in better cases (when the posterior and prior are close). This illustrates the possibility of reinforcing classical generalization bounds with algorithm- and data-dependent components, thus making them more suitable to analyze algorithms that use a large hypothesis space.

In the stochastic contextual bandit setting, regret-minimizing algorithms have been extensively researched, but their instance-minimizing best-arm identification counterparts remain seldom studied. In this work, we focus on the stochastic bandit problem in the $(\epsilon,\delta)$-$\textit{PAC}$ setting: given a policy class $\Pi$ the goal of the learner is to return a policy $\pi\in \Pi$ whose expected reward is within $\epsilon$ of the optimal policy with probability greater than $1-\delta$. We characterize the first $\textit{instance-dependent}$ PAC sample complexity of contextual bandits through a quantity $\rho_{\Pi}$, and provide matching upper and lower bounds in terms of $\rho_{\Pi}$ for the agnostic and linear contextual best-arm identification settings. We show that no algorithm can be simultaneously minimax-optimal for regret minimization and instance-dependent PAC for best-arm identification. Our main result is a new instance-optimal and computationally efficient algorithm that relies on a polynomial number of calls to an argmax oracle.

Most work in neural networks focuses on estimating the conditional mean of a continuous response variable given a set of covariates.In this article, we consider estimating the conditional distribution function using neural networks for both censored and uncensored data. The algorithm is built upon the data structure particularly constructed for the Cox regression with time-dependent covariates. Without imposing any model assumption, we consider a loss function that is based on the full likelihood where the conditional hazard function is the only unknown nonparametric parameter, for which unconstraint optimization methods can be applied. Through simulation studies, we show the proposed method possesses desirable performance, whereas the partial likelihood method and the traditional neural networks with $L_2$ loss yield biased estimates when model assumptions are violated. We further illustrate the proposed method with several real-world data sets. The implementation of the proposed methods is made available at https://github.com/bingqing0729/NNCDE.

submitted by /u/Lakshmireddys [link] [comments]  ( 83 min )

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I don’t got any friends to give the invites to so who needs one! submitted by /u/projhect-AI [link] [comments]  ( 84 min )

Tried to explain as much as possible in the title. I did a "run" of DALL-E and I have already used photoshop's macros to crop each of them in a different file bc I feel like there's an interesting experience in watching it go through similar but different iteractions, but I would like it to be sorted by similarity to make the most impact. Can any of you recommend me a way to do that? The first result I found in google pinged the antivirus so I felt like getting recommendations was the way to go. Here's an example of that kind of images I'm talking about https://imgur.com/a/miG2WWZ submitted by /u/quiteawhile [link] [comments]  ( 84 min )

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I created this Reddit account in 2021 for Crypto only. It's not been used for about 7 months. I'm creating this thread to highlight a pattern I'm noticing in email sent from [noreply@redditmail.com](mailto:noreply@redditmail.com). Every email sent in 2021 up to October was totally related to my Crypto interest and activity here on Reddit. From October 2nd 2021 to April 22nd 2022 there was a gap where Reddit did not send any highlights or promotional emails. It appears all of the emails sent this year know more about me than I have ever shared on Reddit. While I was modding a 3DS it sent 3DS suggestions. Since December I've been experimenting with GPT-3, and now I'm suggested content from this forum. Since childhood I've had a passionate interest in robotics, AI, and software/hardware in g…  ( 103 min )

What do you think of David Deutsch's theory of “universal explainers”? https://www.lesswrong.com/posts/HDyePg6oySYQ9hY4i/david-deutsch-on-universal-explainers-and-ai submitted by /u/Equal-Lingonberry517 [link] [comments]  ( 83 min )

What are the sites/programs that you can test some kind of artificial intelligence for free and uncomplicated? submitted by /u/NaturalMagicCat [link] [comments]  ( 84 min )

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View the tutorial here: HERE This tutorial teaches you how to transfer the style of one image to another image using neural-style-pt. Below is a imgur gallery showing off the transformation process. https://imgur.com/gallery/iMlkkQi Let me know if you have any questions or comments. submitted by /u/mshriver2 [link] [comments]  ( 84 min )

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Imagine a surgeon taking video calls with patients across the globe without the need of a human translator. What if a fledgling startup could easily expand their product across borders and into new geographical markets by offering fluid, accurate, multilingual customer support and sales, all without the need of a live human translator? What happens […]  ( 10 min )

Suppose a triangle has sides a, b, and c. Label the angles opposite these three sides α, β, and γ respectively. Edsger Dijkstra published (EWD975-0) a note proving the following extension of the Pythagorean theorem: sgn(α + β – γ) = sgn(a² + b² – c²). Here the sgn function is -1, 0, or 1 […] Dijkstra extends Pythagoras first appeared on John D. Cook.  ( 4 min )

One simple thing one could do is take the dot product between the current and the n-1 gradient. But this will of course not be very meaningful as what really matters is a (sort-of) average correlation across several iterations, which will not be revealed from doing such a local comparison (using gradients from step n and n-1). Ideally it would be a calculation that would not require keeping around old gradients. Any ideas? submitted by /u/fasttosmile [link] [comments]  ( 85 min )

What are some methods to handle OOV words when generating sequences? For example for some n-gram implementations, I've seen all tokens removed from the candidate list of words to be sampled from given the prior n-gram, and if there are no other candidates the generated text is ended. Curious to learn about some other methods to deal with OOV. submitted by /u/MLJungle [link] [comments]  ( 85 min )

Paper: https://arxiv.org/pdf/2207.01780.pdf Github: https://github.com/salesforce/CodeRL Abstract: Program synthesis or code generation aims to generate a program that satisfies a problem specification. Recent approaches using large-scale pretrained language models (LMs) have shown promising results, yet they have some critical limitations. In particular, they often follow a standard supervised fine-tuning procedure to train a code generation model only from the pairs of natural-language problem descriptions and ground-truth programs. Such paradigm largely ignores some important but potentially useful signals in the problem specification such as unit tests, which thus often results in poor performance when solving complex unseen coding tasks. To address the limitations, we propose "CodeRL", a new framework for program synthesis tasks through pretrained LMs and deep reinforcement learning (RL). Specifically, during training, we treat the code-generating LM as an actor network, and introduce a critic network that is trained to predict the functional correctness of generated programs and provide dense feedback signals to the actor. During inference, we introduce a new generation procedure with a critical sampling strategy that allows a model to automatically regenerate programs based on feedback from example unit tests and critic scores. For the model backbones, we extended the encoder-decoder architecture of CodeT5 with enhanced learning objectives, larger model sizes, and better pretraining data. Our method not only achieves new SOTA results on the challenging APPS benchmark, but also shows strong zero-shot transfer capability with new SOTA results on the simpler MBPP benchmark. https://preview.redd.it/goglny8a30a91.jpg?width=1218&format=pjpg&auto=webp&s=a6f50319637cf85fed2de1d08b407478f6a227aa https://preview.redd.it/vav9glra30a91.jpg?width=1234&format=pjpg&auto=webp&s=19ef106847c090fab438338fad912f1afd75db1a submitted by /u/Singularian2501 [link] [comments]  ( 86 min )

It seems Judea Pearl, Yoshua Bengio, Elias Bareinboim and a handful of other researchers are only people who are working on causal inference and machine learning. Is causal machine learning still a niche field? Also, do you know any researcher working on causal machine learning at Berkeley? submitted by /u/After_Philosopher572 [link] [comments]  ( 87 min )

I wrote a program in Unity that generated millions of fake images using the HDRP rendering pipeline. For starters I only want to detect a bottle of "ITO EN" ice-tea. Here is an example (left is real, right is the fake rendering). I have a simple 3 layer resnet CNN with 3 blocks each, and use a Global Average Pooling layer at the end to visualize the detection. Using the simulation dataset only I get an accuracy of 97% or higher. Using the real dataset I only get ~70% accuracy. I wanna add that this is not a result of over-training, (a) because I use validation set and stop training if it hasn't improved and d (b) the test set performs very well. This is infuriating, because the image dataset is extremely diverse and I use a ton of image transformations in order to provide a very high level of diversity. I also use various levels of lighting, bloom, camera exposures, motion blur, changing materials for all assets, as well as changing the properties for the target (the bottle), such as glossiness, reflection, emissive lighting, and so on. Here is an example for the rendered dataset that is used for training, and here is an example for the real dataset. Anyone got an idea why this isn't working out? submitted by /u/tmuxed [link] [comments]  ( 88 min )

As the title suggests, I would like to know the correct way to pre-process the cityscapes dataset for object detection. There are multiple ways how this can be done. There is a version in Detectron2, in MM Detection, there is this. Which one is the correct way, without getting errors in the labels? Anybody worked with this before? Would be glad if anybody might have an idea. submitted by /u/SeucheAchat9115 [link] [comments]  ( 86 min )

At ZenML, we created a guide to easily run MLOps pipelines on Google Cloud Platform with Vertex AI. I thought I'd share it here because I think it might be useful for people who are just starting MLOps on GCP. Blog post: https://blog.zenml.io/vertex-ai-blog/ Full video: https://youtu.be/qgvmvexGv_c Why is this better than going through the Vertex AI SDK? ZenML steps and pipeline can be written with a simple decorator pattern that is easily approachable for a #datascientist. ZenML takes cares of storing and versioning pythonic objects between steps of a ZenML provides first-class integrations into other MLOps tools that you can leverage natively in your pipelines. For example, you can track experiments on MLFlow easily. ZenML pipelines can be run locally first, and then deployed instantly. You can run a ZenML pipeline not only on Vertex, but also #Airflow, #Kubeflow, #Kubernetes, or whereever else you'd like!📷Watch the full video: https://www.youtube.com/watch?v=qgvmvexGv_c&ab_channel=ZenML I bet the GCP Vertex AI folk here might like the above video. It isn't just about ZenML either but more of a broader look into the different components that go into running ML in production on GCP (Container registry, Cloud Storage, Secret Manager, Vertex, Cloud SQL) Would love to hear more feedback on the video or blog! submitted by /u/htahir1 [link] [comments]  ( 86 min )

I thought I share some of the Sherlock Holmes stories I created with various prompts using GPT-3. Might be fun for some fans, but overall the stories are all a bit superficial, although some of them made me laugh (the fourth one in particular). ​ John Watson was having a cup of tea in his flat when he heard a knock at the door. He got up to answer it, and found Sherlock Holmes standing there, looking rather grave. "Watson, I'm afraid I have some bad news," said Sherlock. "I've just been to Baker Street, where I found Mrs. Hudson in a state of hysterics. It seems that a Mr. Bartholomew Jones was found dead in his study, and Mrs. Hudson is convinced that it was murder." "That is rather shocking," said Watson. "Do you have any idea who might have done it?" "I have some suspicions," …  ( 100 min )

Hello, i am happy to share with you one of my latest work for domain adaptation built on top of Detectron2 object detector model (RetinaNet). Link to the github repo STMDA-RetinaNet: https://github.com/fpv-iplab/STMDA-RetinaNet submitted by /u/CapitalShake3085 [link] [comments]  ( 85 min )

Machine learning solutions are already embedded in the finance and banking industry. In this article, we reviewed the most popular use cases of ML in banking and shared practical tips on how to implement it into your business.https://exadel.com/news/how-machine-learning-is-used-in-finance-and-banking submitted by /u/lklimusheuskaja [link] [comments]  ( 85 min )

The Jupyter Notebook Competition deadline is fast approaching! https://preview.redd.it/gy6m0myhyx991.png?width=1920&format=png&auto=webp&s=3039abe962df07df74740772994f17502fa686bb Don't miss out on your chance to contribute to a community-driven resource of notebooks on the Copernicus WEkEO platform, AND be in with a chance of winning cash prizes! Visit: https://www.eumetsat.int/features/new-jupyter-notebook-competition submitted by /u/EUMETSAT [link] [comments]  ( 85 min )

Per his tweet at https://twitter.com/goodfellow_ian/status/1544638709039091717, Goodfellow will be a research scientist under Oriol Vinyals' Deep Learning team. submitted by /u/The_Removed [link] [comments]  ( 90 min )

Hi all, I've been an active practitioner in Deep Learning and then wanted to build something in MLOps. So wanted to dig deeper in how DevOps evolved and wanted to check if MLOps can take the same path. The findings are really great. Absolutely every tool doing well in the market is a clear replacement for DevOps tool in MLOps. Here is my blog on it. Looking for feedback. If you have any comments, let me know. Will add them. https://sachinchandra.substack.com/p/bringing-software-development-principles submitted by /u/scb_11 [link] [comments]  ( 89 min )

Posted by Yundi Qian, Software Engineer, Google Research and Mircea Trofin, Software Engineer, Google Core The question of how to compile faster and smaller code arose together with the birth of modem computers. Better code optimization can significantly reduce the operational cost of large datacenter applications. The size of compiled code matters the most to mobile and embedded systems or software deployed on secure boot partitions, where the compiled binary must fit in tight code size budgets. With advances in the field, the headroom has been heavily squeezed with increasingly complicated heuristics, impeding maintenance and further improvements. Recent research has shown that machine learning (ML) can unlock more opportunities in compiler optimization by replacing complicated heuri…  ( 25 min )

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I need to load some offline RL data, which is accessible via a similar interface as `d4rl`. It uses a HDF5 file for storage under the hood. I want to write a Dataloader in PyTorch, which is something I haven't done before for custom data. I have started implementing a custom subclass to PyTorch's `Dataset`. In the docs it says that `__getitem__` shall return one example at the given index. I'm worried that naively getting one data point from the HDF5 file and returning that will be way too slow. Am I going to have to come up with a very smart `__getitem__` function that loads more than required from disk, saves that in a smart data structure, and next time checks that data structure first before issuing a I/O request? Edit: typo submitted by /u/lemlo100 [link] [comments]  ( 84 min )

Hello everyone! I just started working with multi-armed bandits. I have two directions I could explore, and if anyone know any resources (book, research papers. etc) that would be awesome! I would like to implement multiple agent which can share knowledge with each other. For example, two agents who sell ice cream. They want to offer the best flavor, but sell at different locations which can affect which is the actual best flavor at that location. So the best option might not be the same, but if a lot of costumers start to buy a specific flavor at one place, it might be worth exploring for the other agent. Trying to determine best price (continuous value), arms are now placed at different prices. Since we now have distinct prices, the actual best price will most likely not be among the options. How could one tackle this problem? I’m not expecting anyone to take the time and explain my problems, but if you know of any good resources, please share! Thanks in advance! :) submitted by /u/AnkanTV [link] [comments]  ( 85 min )

AI has brought a new life to art.  ( 7 min )

Testing Data Vs Training Data In Machine Learning  ( 14 min )

Piction Health, founded by Susan Conover SM ’15, uses machine learning to help physicians identify and manage skin disease.  ( 8 min )

Deep neural networks are the most commonly used function approximators in offline Reinforcement Learning these days. Prior works have shown that neural nets trained with TD-learning and gradient descent can exhibit implicit regularization that can be characterized by under-parameterization of these networks. Specifically, the rank of the penultimate feature layer, also called \textit{effective rank}, has been observed to drastically collapse during the training. In turn, this collapse has been argued to reduce the model's ability to further adapt in later stages of learning, leading to the diminished final performance. Such an association between the effective rank and performance makes effective rank compelling for offline RL, primarily for offline policy evaluation. In this work, we conduct a careful empirical study on the relation between effective rank and performance on three offline RL datasets : bsuite, Atari, and DeepMind lab. We observe that a direct association exists only in restricted settings and disappears in the more extensive hyperparameter sweeps. Also, we empirically identify three phases of learning that explain the impact of implicit regularization on the learning dynamics and found that bootstrapping alone is insufficient to explain the collapse of the effective rank. Further, we show that several other factors could confound the relationship between effective rank and performance and conclude that studying this association under simplistic assumptions could be highly misleading.  ( 3 min )

We consider the problem of maximizing a non-concave Lipschitz multivariate function over a compact domain by sequentially querying its (possibly perturbed) values. We study a natural algorithm designed originally by Piyavskii and Shubert in 1972, for which we prove new bounds on the number of evaluations of the function needed to reach or certify a given optimization accuracy. Our analysis uses a bandit-optimization viewpoint and solves an open problem from Hansen et al.\ (1991) by bounding the number of evaluations to certify a given accuracy with a near-optimal sum of packing numbers.  ( 2 min )

Variational autoencoders (VAEs) and other generative methods have garnered growing interest not just for their generative properties but also for the ability to dis-entangle a low-dimensional latent variable space. However, few existing generative models take causality into account. We propose a new decoder based framework named the Causal Counterfactual Generative Model (CCGM), which includes a partially trainable causal layer in which a part of a causal model can be learned without significantly impacting reconstruction fidelity. By learning the causal relationships between image semantic labels or tabular variables, we can analyze biases, intervene on the generative model, and simulate new scenarios. Furthermore, by modifying the causal structure, we can generate samples outside the domain of the original training data and use such counterfactual models to de-bias datasets. Thus, datasets with known biases can still be used to train the causal generative model and learn the causal relationships, but we can produce de-biased datasets on the generative side. Our proposed method combines a causal latent space VAE model with specific modification to emphasize causal fidelity, enabling finer control over the causal layer and the ability to learn a robust intervention framework. We explore how better disentanglement of causal learning and encoding/decoding generates higher causal intervention quality. We also compare our model against similar research to demonstrate the need for explicit generative de-biasing beyond interventions. Our initial experiments show that our model can generate images and tabular data with high fidelity to the causal framework and accommodate explicit de-biasing to ignore undesired relationships in the causal data compared to the baseline.  ( 3 min )

The area under the ROC curve (AUROC) has been vigorously applied for imbalanced classification and moreover combined with deep learning techniques. However, there is no existing work that provides sound information for peers to choose appropriate deep AUROC maximization techniques. In this work, we fill this gap from three aspects. (i) We benchmark a variety of loss functions with different algorithmic choices for deep AUROC optimization problem. We study the loss functions in two categories: pairwise loss and composite loss, which includes a total of 10 loss functions. Interestingly, we find composite loss, as an innovative loss function class, shows more competitive performance than pairwise loss from both training convergence and testing generalization perspectives. Nevertheless, data with more corrupted labels favors a pairwise symmetric loss. (ii) Moreover, we benchmark and highlight the essential algorithmic choices such as positive sampling rate, regularization, normalization/activation, and optimizers. Key findings include: higher positive sampling rate is likely to be beneficial for deep AUROC maximization; different datasets favors different weights of regularizations; appropriate normalization techniques, such as sigmoid and $\ell_2$ score normalization, could improve model performance. (iii) For optimization aspect, we benchmark SGD-type, Momentum-type, and Adam-type optimizers for both pairwise and composite loss. Our findings show that although Adam-type method is more competitive from training perspective, but it does not outperform others from testing perspective.  ( 3 min )

Hamiltonian Monte Carlo (HMC) is a popular method in sampling. While there are quite a few works of studying this method on various aspects, an interesting question is how to choose its integration time to achieve acceleration. In this work, we consider accelerating the process of sampling from a distribution $\pi(x) \propto \exp(-f(x))$ via HMC via time-varying integration time. When the potential $f$ is $L$-smooth and $m$-strongly convex, i.e.\ for sampling from a log-smooth and strongly log-concave target distribution $\pi$, it is known that under a constant integration time, the number of iterations that ideal HMC takes to get an $\epsilon$ Wasserstein-2 distance to the target $\pi$ is $O( \kappa \log \frac{1}{\epsilon} )$, where $\kappa := \frac{L}{m}$ is the condition number. We propose a scheme of time-varying integration time based on the roots of Chebyshev polynomials. We show that in the case of quadratic potential $f$, i.e., when the target $\pi$ is a Gaussian distribution, ideal HMC with this choice of integration time only takes $O( \sqrt{\kappa} \log \frac{1}{\epsilon} )$ number of iterations to reach Wasserstein-2 distance less than $\epsilon$; this improvement on the dependence on condition number is akin to acceleration in optimization. The design and analysis of HMC with the proposed integration time is built on the tools of Chebyshev polynomials. Experiments find the advantage of adopting our scheme of time-varying integration time even for sampling from distributions with smooth strongly convex potentials that are not quadratic.  ( 3 min )

We propose a data-driven framework to increase the computational efficiency of the explicit finite element method in the structural analysis of soft tissue. An encoder-decoder long short-term memory deep neural network is trained based on the data produced by an explicit, distributed finite element solver. We leverage this network to predict synchronized displacements at shared nodes, minimizing the amount of communication between processors. We perform extensive numerical experiments to quantify the accuracy and stability of the proposed synchronization-avoiding algorithm.  ( 2 min )

We study the stochastic shortest path (SSP) problem in reinforcement learning with linear function approximation, where the transition kernel is represented as a linear mixture of unknown models. We call this class of SSP problems as linear mixture SSPs. We propose a novel algorithm with Hoeffding-type confidence sets for learning the linear mixture SSP, which can attain an $\tilde{\mathcal{O}}(d B_{\star}^{1.5}\sqrt{K/c_{\min}})$ regret. Here $K$ is the number of episodes, $d$ is the dimension of the feature mapping in the mixture model, $B_{\star}$ bounds the expected cumulative cost of the optimal policy, and $c_{\min}>0$ is the lower bound of the cost function. Our algorithm also applies to the case when $c_{\min} = 0$, and an $\tilde{\mathcal{O}}(K^{2/3})$ regret is guaranteed. To the best of our knowledge, this is the first algorithm with a sublinear regret guarantee for learning linear mixture SSP. Moreover, we design a refined Bernstein-type confidence set and propose an improved algorithm, which provably achieves an $\tilde{\mathcal{O}}(d B_{\star}\sqrt{K/c_{\min}})$ regret. In complement to the regret upper bounds, we also prove a lower bound of $\Omega(dB_{\star} \sqrt{K})$. Hence, our improved algorithm matches the lower bound up to a $1/\sqrt{c_{\min}}$ factor and poly-logarithmic factors, achieving a near-optimal regret guarantee.  ( 3 min )

Stochastic processes provide a mathematically elegant way model complex data. In theory, they provide flexible priors over function classes that can encode a wide range of interesting assumptions. In practice, however, efficient inference by optimisation or marginalisation is difficult, a problem further exacerbated with big data and high dimensional input spaces. We propose a novel variational autoencoder (VAE) called the prior encoding variational autoencoder ($\pi$VAE). The $\pi$VAE is finitely exchangeable and Kolmogorov consistent, and thus is a continuous stochastic process. We use $\pi$VAE to learn low dimensional embeddings of function classes. We show that our framework can accurately learn expressive function classes such as Gaussian processes, but also properties of functions to enable statistical inference (such as the integral of a log Gaussian process). For popular tasks, such as spatial interpolation, $\pi$VAE achieves state-of-the-art performance both in terms of accuracy and computational efficiency. Perhaps most usefully, we demonstrate that the low dimensional independently distributed latent space representation learnt provides an elegant and scalable means of performing Bayesian inference for stochastic processes within probabilistic programming languages such as Stan.  ( 3 min )

In this paper, we propose a novel benchmark called the StarCraft Multi-Agent Challenges+, where agents learn to perform multi-stage tasks and to use environmental factors without precise reward functions. The previous challenges (SMAC) recognized as a standard benchmark of Multi-Agent Reinforcement Learning are mainly concerned with ensuring that all agents cooperatively eliminate approaching adversaries only through fine manipulation with obvious reward functions. This challenge, on the other hand, is interested in the exploration capability of MARL algorithms to efficiently learn implicit multi-stage tasks and environmental factors as well as micro-control. This study covers both offensive and defensive scenarios. In the offensive scenarios, agents must learn to first find opponents and then eliminate them. The defensive scenarios require agents to use topographic features. For example, agents need to position themselves behind protective structures to make it harder for enemies to attack. We investigate MARL algorithms under SMAC+ and observe that recent approaches work well in similar settings to the previous challenges, but misbehave in offensive scenarios. Additionally, we observe that an enhanced exploration approach has a positive effect on performance but is not able to completely solve all scenarios. This study proposes new directions for future research.  ( 3 min )

For graph-valued data sampled iid from a distribution $\mu$, the sample moments are computed with respect to a choice of metric. In this work, we equip the set of graphs with the pseudo-metric defined by the $\ell_2$ norm between the eigenvalues of the respective adjacency matrices. We use this pseudo metric and the respective sample moments of a graph valued data set to infer the parameters of a distribution $\hat{\mu}$ and interpret this distribution as an approximation of $\mu$. We verify experimentally that complex distributions $\mu$ can be approximated well taking this approach.  ( 2 min )

Mobile devices and the immense amount and variety of data they generate are key enablers of machine learning (ML)-based applications. Traditional ML techniques have shifted toward new paradigms such as federated (FL) and split learning (SL) to improve the protection of user's data privacy. However, these paradigms often rely on server(s) located in the edge or cloud to train computationally-heavy parts of a ML model to avoid draining the limited resource on client devices, resulting in exposing device data to such third parties. This work proposes an alternative approach to train computationally-heavy ML models in user's devices themselves, where corresponding device data resides. Specifically, we focus on GANs (generative adversarial networks) and leverage their inherent privacy-preserving attribute. We train the discriminative part of a GAN with raw data on user's devices, whereas the generative model is trained remotely (e.g., server) for which there is no need to access sensor true data. Moreover, our approach ensures that the computational load of training the discriminative model is shared among user's devices-proportional to their computation capabilities-by means of SL. We implement our proposed collaborative training scheme of a computationally-heavy GAN model in real resource-constrained devices. The results show that our system preserves data privacy, keeps a short training time, and yields same accuracy of model training in unconstrained devices (e.g., cloud). Our code can be found on https://github.com/YukariSonz/FSL-GAN  ( 3 min )

Adversarial patch attacks mislead neural networks by injecting adversarial pixels within a designated local region. Patch attacks can be highly effective in a variety of tasks and physically realizable via attachment (e.g. a sticker) to the real-world objects. Despite the diversity in attack patterns, adversarial patches tend to be highly textured and different in appearance from natural images. We exploit this property and present PatchZero, a task-agnostic defense against white-box adversarial patches. Specifically, our defense detects the adversarial pixels and "zeros out" the patch region by repainting with mean pixel values. We formulate the patch detection problem as a semantic segmentation task such that our model can generalize to patches of any size and shape. We further design a two-stage adversarial training scheme to defend against the stronger adaptive attacks. We thoroughly evaluate PatchZero on the image classification (ImageNet, RESISC45), object detection (PASCAL VOC), and video classification (UCF101) datasets. Our method achieves SOTA robust accuracy without any degradation in the benign performance.  ( 2 min )

Traditionally, extracting patterns from eye movement data relies on statistics of different macro-events such as fixations and saccades. This requires an additional preprocessing step to separate the eye movement subtypes, often with a number of parameters on which the classification results depend. Besides that, definitions of such macro events are formulated in different ways by different researchers. We propose an application of a new class of features to the quantitative analysis of personal eye movement trajectories structure. This new class of features based on algebraic topology allows extracting patterns from different modalities of gaze such as time series of coordinates and amplitudes, heatmaps, and point clouds in a unified way at all scales from micro to macro. We experimentally demonstrate the competitiveness of the new class of features with the traditional ones and their significant synergy while being used together for the person authentication task on the recently published eye movement trajectories dataset.  ( 2 min )

Understanding how machine learning models generalize to new environments is a critical part of their safe deployment. Recent work has proposed a variety of complexity measures that directly predict or theoretically bound the generalization capacity of a model. However, these methods rely on a strong set of assumptions that in practice are not always satisfied. Motivated by the limited settings in which existing measures can be applied, we propose a novel complexity measure based on the local manifold smoothness of a classifier. We define local manifold smoothness as a classifier's output sensitivity to perturbations in the manifold neighborhood around a given test point. Intuitively, a classifier that is less sensitive to these perturbations should generalize better. To estimate smoothness we sample points using data augmentation and measure the fraction of these points classified into the majority class. Our method only requires selecting a data augmentation method and makes no other assumptions about the model or data distributions, meaning it can be applied even in out-of-domain (OOD) settings where existing methods cannot. In experiments on robustness benchmarks in image classification, sentiment analysis, and natural language inference, we demonstrate a strong and robust correlation between our manifold smoothness measure and actual OOD generalization on over 3,000 models evaluated on over 100 train/test domain pairs.  ( 3 min )

Intelligent Traffic Light Control System (ITLCS) is a typical Multi-Agent System (MAS), which comprises multiple roads and traffic lights.Constructing a model of MAS for ITLCS is the basis to alleviate traffic congestion. Existing approaches of MAS are largely based on Multi-Agent Deep Reinforcement Learning (MADRL). Although the Deep Neural Network (DNN) of MABRL is effective, the training time is long, and the parameters are difficult to trace. Recently, Broad Learning Systems (BLS) provided a selective way for learning in the deep neural networks by a flat network. Moreover, Broad Reinforcement Learning (BRL) extends BLS in Single Agent Deep Reinforcement Learning (SADRL) problem with promising results. However, BRL does not focus on the intricate structures and interaction of agents. Motivated by the feature of MADRL and the issue of BRL, we propose a Multi-Agent Broad Reinforcement Learning (MABRL) framework to explore the function of BLS in MAS. Firstly, unlike most existing MADRL approaches, which use a series of deep neural networks structures, we model each agent with broad networks. Then, we introduce a dynamic self-cycling interaction mechanism to confirm the "3W" information: When to interact, Which agents need to consider, What information to transmit. Finally, we do the experiments based on the intelligent traffic light control scenario. We compare the MABRL approach with six different approaches, and experimental results on three datasets verify the effectiveness of MABRL.  ( 3 min )

Study Objectives: Inter-scorer variability in scoring polysomnograms is a well-known problem. Most of the existing automated sleep scoring systems are trained using labels annotated by a single scorer, whose subjective evaluation is transferred to the model. When annotations from two or more scorers are available, the scoring models are usually trained on the scorer consensus. The averaged scorer's subjectivity is transferred into the model, losing information about the internal variability among different scorers. In this study, we aim to insert the multiple-knowledge of the different physicians into the training procedure.The goal is to optimize a model training, exploiting the full information that can be extracted from the consensus of a group of scorers. Methods: We train two lightweight deep learning based models on three different multi-scored databases. We exploit the label smoothing technique together with a soft-consensus (LSSC) distribution to insert the multiple-knowledge in the training procedure of the model. We introduce the averaged cosine similarity metric (ACS) to quantify the similarity between the hypnodensity-graph generated by the models with-LSSC and the hypnodensity-graph generated by the scorer consensus. Results: The performance of the models improves on all the databases when we train the models with our LSSC. We found an increase in ACS (up to 6.4%) between the hypnodensity-graph generated by the models trained with-LSSC and the hypnodensity-graph generated by the consensus. Conclusions: Our approach definitely enables a model to better adapt to the consensus of the group of scorers. Future work will focus on further investigations on different scoring architectures.  ( 3 min )

Graph Neural Networks (GNNs) have achieved state-of-the-art results on many graph analysis tasks such as node classification and link prediction. However, important unsupervised problems on graphs, such as graph clustering, have proved more resistant to advances in GNNs. Graph clustering has the same overall goal as node pooling in GNNs - does this mean that GNN pooling methods do a good job at clusterings graphs? Surprisingly, the answer is no - current GNN pooling methods often fail to recover the cluster structure in cases where simple baselines, such as k-means applied on learned representations, work well. We investigate further by carefully designing a set of experiments to study different signal-to-noise scenarios both in graph structure and attribute data. To address these methods' poor performance in clustering, we introduce Deep Modularity Networks (DMoN), an unsupervised pooling method inspired by the modularity measure of clustering quality, and show how it tackles recovery of the challenging clustering structure of real-world graphs. Similarly, on real-world data, we show that DMoN produces high quality clusters which correlate strongly with ground truth labels, achieving state-of-the-art results with over 40% improvement over other pooling methods across different metrics.  ( 3 min )

Image-to-image (I2I) translation is a challenging topic in computer vision. We divide this problem into three tasks: strongly constrained translation, normally constrained translation, and weakly constrained translation. The constraint here indicates the extent to which the content or semantic information in the original image is preserved. Although previous approaches have achieved good performance in weakly constrained tasks, they failed to fully preserve the content in both strongly and normally constrained tasks, including photo-realism synthesis, style transfer, and colorization, etc. To achieve content-preserving transfer in strongly constrained and normally constrained tasks, we propose StyleFlow, a new I2I translation model that consists of normalizing flows and a novel Style-Aware Normalization (SAN) module. With the invertible network structure, StyleFlow first projects input images into deep feature space in the forward pass, while the backward pass utilizes the SAN module to perform content-fixed feature transformation and then projects back to image space. Our model supports both image-guided translation and multi-modal synthesis. We evaluate our model in several I2I translation benchmarks, and the results show that the proposed model has advantages over previous methods in both strongly constrained and normally constrained tasks.  ( 2 min )

Cohort studies are increasingly using accelerometers for physical activity and sedentary behavior estimation. These devices tend to be less error-prone than self-report, can capture activity throughout the day, and are economical. However, previous methods for estimating sedentary behavior based on hip-worn data are often invalid or suboptimal under free-living situations and subject-to-subject variation. In this paper, we propose a local Markov switching model that takes this situation into account, and introduce a general procedure for posture classification and sedentary behavior analysis that fits the model naturally. Our method features changepoint detection methods in time series and also a two stage classification step that labels data into 3 classes(sitting, standing, stepping). Through a rigorous training-testing paradigm, we showed that our approach achieves > 80% accuracy. In addition, our method is robust and easy to interpret.  ( 2 min )

Random Forests (RF) is a popular machine learning method for classification and regression problems. It involves a bagging application to decision tree models. One of the primary advantages of the Random Forests model is the reduction in the variance of the forecast. In large scale applications of the model with millions of data points and hundreds of features, the size of the fitted objects can get very large and reach the limits on the available space in production setups, depending on the number and depth of the trees. This could be especially challenging when trained models need to be downloaded on-demand to small devices with limited memory. There is a need to approximate the trained RF models to significantly reduce the model size without losing too much of prediction accuracy. In this project we study methods that approximate each fitted tree in the Random Forests model using the multinomial allocation of the data points to the leafs. Specifically, we begin by studying whether fitting a multinomial logistic regression (and subsequently, a generalized additive model (GAM) extension) to the output of each tree helps reduce the size while preserving the prediction quality.  ( 2 min )

Personalized medicine, a paradigm of medicine tailored to a patient's characteristics, is an increasingly attractive field in health care. An important goal of personalized medicine is to identify a subgroup of patients, based on baseline covariates, that benefits more from the targeted treatment than other comparative treatments. Most of the current subgroup identification methods only focus on obtaining a subgroup with an enhanced treatment effect without paying attention to subgroup size. Yet, a clinically meaningful subgroup learning approach should identify the maximum number of patients who can benefit from the better treatment. In this paper, we present an optimal subgroup selection rule (SSR) that maximizes the number of selected patients, and in the meantime, achieves the pre-specified clinically meaningful mean outcome, such as the average treatment effect. We derive two equivalent theoretical forms of the optimal SSR based on the contrast function that describes the treatment-covariates interaction in the outcome. We further propose a ConstrAined PolIcy Tree seArch aLgorithm (CAPITAL) to find the optimal SSR within the interpretable decision tree class. The proposed method is flexible to handle multiple constraints that penalize the inclusion of patients with negative treatment effects, and to address time to event data using the restricted mean survival time as the clinically interesting mean outcome. Extensive simulations, comparison studies, and real data applications are conducted to demonstrate the validity and utility of our method.

A finitely repeated game is a dynamic game in which a simultaneous game is played finitely many times. GANs contain two competing modules: the generator module is trained to generate new examples, and the discriminator module is trained to discriminate real examples from generated examples. Training procedure of GAN is a finitely repeated game in which each module tries to optimize it's error at every instance of simultaneous game in a non-cooperative manner. We observed that we can achieve more accurate training, if at each instance of simultaneous game the stronger module cooperate with weaker module and only weaker module only optimize it's error.

Physics-informed neural networks (PINNs) have been increasingly employed due to their capability of modeling complex physics systems. To achieve better expressiveness, increasingly larger network sizes are required in many problems. This has caused challenges when we need to train PINNs on edge devices with limited memory, computing and energy resources. To enable training PINNs on edge devices, this paper proposes an end-to-end compressed PINN based on Tensor-Train decomposition. In solving a Helmholtz equation, our proposed model significantly outperforms the original PINNs with few parameters and achieves satisfactory prediction with up to 15$\times$ overall parameter reduction.

Virtual reality (VR) headsets provide an immersive, stereoscopic visual experience, but at the cost of blocking users from directly observing their physical environment. Passthrough techniques are intended to address this limitation by leveraging outward-facing cameras to reconstruct the images that would otherwise be seen by the user without the headset. This is inherently a real-time view synthesis challenge, since passthrough cameras cannot be physically co-located with the eyes. Existing passthrough techniques suffer from distracting reconstruction artifacts, largely due to the lack of accurate depth information (especially for near-field and disoccluded objects), and also exhibit limited image quality (e.g., being low resolution and monochromatic). In this paper, we propose the first learned passthrough method and assess its performance using a custom VR headset that contains a stereo pair of RGB cameras. Through both simulations and experiments, we demonstrate that our learned passthrough method delivers superior image quality compared to state-of-the-art methods, while meeting strict VR requirements for real-time, perspective-correct stereoscopic view synthesis over a wide field of view for desktop-connected headsets.

Data augmentation via voice conversion (VC) has been successfully applied to low-resource expressive text-to-speech (TTS) when only neutral data for the target speaker are available. Although the quality of VC is crucial for this approach, it is challenging to learn a stable VC model because the amount of data is limited in low-resource scenarios, and highly expressive speech has large acoustic variety. To address this issue, we propose a novel data augmentation method that combines pitch-shifting and VC techniques. Because pitch-shift data augmentation enables the coverage of a variety of pitch dynamics, it greatly stabilizes training for both VC and TTS models, even when only 1,000 utterances of the target speaker's neutral data are available. Subjective test results showed that a FastSpeech 2-based emotional TTS system with the proposed method improved naturalness and emotional similarity compared with conventional methods.

Model-based reinforcement learning has attracted wide attention due to its superior sample efficiency. Despite its impressive success so far, it is still unclear how to appropriately schedule the important hyperparameters to achieve adequate performance, such as the real data ratio for policy optimization in Dyna-style model-based algorithms. In this paper, we first theoretically analyze the role of real data in policy training, which suggests that gradually increasing the ratio of real data yields better performance. Inspired by the analysis, we propose a framework named AutoMBPO to automatically schedule the real data ratio as well as other hyperparameters in training model-based policy optimization (MBPO) algorithm, a representative running case of model-based methods. On several continuous control tasks, the MBPO instance trained with hyperparameters scheduled by AutoMBPO can significantly surpass the original one, and the real data ratio schedule found by AutoMBPO shows consistency with our theoretical analysis.

In Cultural Heritage, hyperspectral images are commonly used since they provide extended information regarding the optical properties of materials. Thus, the processing of such high-dimensional data becomes challenging from the perspective of machine learning techniques to be applied. In this paper, we propose a Rank-$R$ tensor-based learning model to identify and classify material defects on Cultural Heritage monuments. In contrast to conventional deep learning approaches, the proposed high order tensor-based learning demonstrates greater accuracy and robustness against overfitting. Experimental results on real-world data from UNESCO protected areas indicate the superiority of the proposed scheme compared to conventional deep learning models.

There is a growing interest in the challenging visual perception task of learning from long-tailed class distributions. The extreme class imbalance in the training dataset biases the model to prefer to recognize majority-class data over minority-class data. Recently, the dual branch network (DBN) framework has been proposed, where two branch networks; the conventional branch and the re-balancing branch were employed to improve the accuracy of long-tailed visual recognition. The re-balancing branch uses a reverse sampler to generate class-balanced training samples to mitigate bias due to class imbalance. Although this strategy has been quite successful in handling bias, using a reversed sampler for training can degrade the representation learning performance. To alleviate this issue, the conventional method used a carefully designed cumulative learning strategy, in which the influence of the re-balancing branch gradually increases throughout the entire training phase. In this study, we aim to develop a simple yet effective method to improve the performance of DBN without cumulative learning that is difficult to optimize. We devise a simple data augmentation method termed bilateral mixup augmentation, which combines one sample from the uniform sampler with another sample from the reversed sampler to produce a training sample. Furthermore, we present class-conditional temperature scaling that mitigates bias toward the majority class for the proposed DBN architecture. Our experiments performed on widely used long-tailed visual recognition datasets show that bilateral mixup augmentation is quite effective in improving the representation learning performance of DBNs, and that the proposed method achieves state-of-the-art performance for some categories.

In this paper we provide stability results for algebraic neural networks (AlgNNs) based on non commutative algebras. AlgNNs are stacked layered structures with each layer associated to an algebraic signal model (ASM) determined by an algebra, a vector space, and a homomorphism. Signals are modeled as elements of the vector space, filters are elements in the algebra, while the homomorphism provides a realization of the filters as concrete operators. We study the stability of the algebraic filters in non commutative algebras to perturbations on the homomorphisms, and we provide conditions under which stability is guaranteed. We show that the commutativity between shift operators and between shifts and perturbations does not affect the property of an architecture of being stable. This provides an answer to the question of whether shift invariance was a necessary attribute of convolutional architectures to guarantee stability. Additionally, we show that although the frequency responses of filters in non commutative algebras exhibit substantial differences with respect to filters in commutative algebras, their derivatives for stable filters have a similar behavior.

We consider the problem of Sampling Transition Paths. Given two metastable conformational states of a molecular system, eg. a folded and unfolded protein, we aim to sample the most likely transition path between the two states. Sampling such a transition path is computationally expensive due to the existence of high free energy barriers between the two states. To circumvent this, previous work has focused on simplifying the trajectories to occur along specific molecular descriptors called Collective Variables (CVs). However, finding CVs is not trivial and requires chemical intuition. For larger molecules, where intuition is not sufficient, using these CV-based methods biases the transition along possibly irrelevant dimensions. Instead, this work proposes a method for sampling transition paths that consider the entire geometry of the molecules. To achieve this, we first relate the problem to recent work on the Schrodinger bridge problem and stochastic optimal control. Using this relation, we construct a method that takes into account important characteristics of molecular systems such as second-order dynamics and invariance to rotations and translations. We demonstrate our method on the commonly studied Alanine Dipeptide, but also consider larger proteins such as Polyproline and Chignolin.

Multimodal learning is a framework for building models that make predictions based on different types of modalities. Important challenges in multimodal learning are the inference of shared representations from arbitrary modalities and cross-modal generation via these representations; however, achieving this requires taking the heterogeneous nature of multimodal data into account. In recent years, deep generative models, i.e., generative models in which distributions are parameterized by deep neural networks, have attracted much attention, especially variational autoencoders, which are suitable for accomplishing the above challenges because they can consider heterogeneity and infer good representations of data. Therefore, various multimodal generative models based on variational autoencoders, called multimodal deep generative models, have been proposed in recent years. In this paper, we provide a categorized survey of studies on multimodal deep generative models.

Deep neural networks have been extremely successful as highly accurate wave function ans\"atze for variational Monte Carlo calculations of molecular ground states. We present an extension of one such ansatz, FermiNet, to calculations of the ground states of periodic Hamiltonians, and study the homogeneous electron gas. FermiNet calculations of the ground-state energies of small electron gas systems are in excellent agreement with previous initiator full configuration interaction quantum Monte Carlo and diffusion Monte Carlo calculations. We investigate the spin-polarized homogeneous electron gas and demonstrate that the same neural network architecture is capable of accurately representing both the delocalized Fermi liquid state and the localized Wigner crystal state. The network is given no \emph{a priori} knowledge that a phase transition exists, but converges on the translationally invariant ground state at high density and spontaneously breaks the symmetry to produce the crystalline ground state at low density.

In the semi-supervised learning field, Graph Convolution Network (GCN), as a variant model of GNN, has achieved promising results for non-Euclidean data by introducing convolution into GNN. However, GCN and its variant models fail to safely use the information of risk unlabeled data, which will degrade the performance of semi-supervised learning. Therefore, we propose a Safe GCN framework (Safe-GCN) to improve the learning performance. In the Safe-GCN, we design an iterative process to label the unlabeled data. In each iteration, a GCN and its supervised version(S-GCN) are learned to find the unlabeled data with high confidence. The high-confidence unlabeled data and their pseudo labels are then added to the label set. Finally, both added unlabeled data and labeled ones are used to train a S-GCN which can achieve the safe exploration of the risk unlabeled data and enable safe use of large numbers of unlabeled data. The performance of Safe-GCN is evaluated on three well-known citation network datasets and the obtained results demonstrate the effectiveness of the proposed framework over several graph-based semi-supervised learning methods.

Attention mechanisms are dominating the explainability of deep models. They produce probability distributions over the input, which are widely deemed as feature-importance indicators. However, in this paper, we find one critical limitation in attention explanations: weakness in identifying the polarity of feature impact. This would be somehow misleading -- features with higher attention weights may not faithfully contribute to model predictions; instead, they can impose suppression effects. With this finding, we reflect on the explainability of current attention-based techniques, such as Attentio$\odot$Gradient and LRP-based attention explanations. We first propose an actionable diagnostic methodology (henceforth faithfulness violation test) to measure the consistency between explanation weights and the impact polarity. Through the extensive experiments, we then show that most tested explanation methods are unexpectedly hindered by the faithfulness violation issue, especially the raw attention. Empirical analyses on the factors affecting violation issues further provide useful observations for adopting explanation methods in attention models.

Data insufficiency problem (i.e., data missing and label scarcity issues) caused by inadequate services and infrastructures or unbalanced development levels of cities has seriously affected the urban computing tasks in real scenarios. Prior transfer learning methods inspire an elegant solution to the data insufficiency, but are only concerned with one kind of insufficiency issue and fail to give consideration to both sides. In addition, most previous cross-city transfer methods overlooks the inter-city data privacy which is a public concern in practical application. To address above challenging problems, we propose a novel Cross-city Federated Transfer Learning framework (CcFTL) to cope with the data insufficiency and privacy problems. Concretely, CcFTL transfers the relational knowledge from multiple rich-data source cities to the target city. Besides, the model parameters specific to the target task are firstly trained on the source data and then fine-tuned to the target city by parameter transfer. With our adaptation of federated training and homomorphic encryption settings, CcFTL can effectively deal with the data privacy problem among cities. We take the urban region profiling as an application of smart cities and evaluate the proposed method with a real-world study. The experiments demonstrate the notable superiority of our framework over several competitive state-of-the-art models.

In safety-critical deep learning applications robustness measurement is a vital pre-deployment phase. However, existing robustness verification methods are not sufficiently practical for deploying machine learning systems in the real world. On the one hand, these methods attempt to claim that no perturbations can ``fool'' deep neural networks (DNNs), which may be too stringent in practice. On the other hand, existing works rigorously consider $L_p$ bounded additive perturbations on the pixel space, although perturbations, such as colour shifting and geometric transformations, are more practically and frequently occurring in the real world. Thus, from the practical standpoint, we present a novel and general {\it probabilistic robustness assessment method} (PRoA) based on the adaptive concentration, and it can measure the robustness of deep learning models against functional perturbations. PRoA can provide statistical guarantees on the probabilistic robustness of a model, \textit{i.e.}, the probability of failure encountered by the trained model after deployment. Our experiments demonstrate the effectiveness and flexibility of PRoA in terms of evaluating the probabilistic robustness against a broad range of functional perturbations, and PRoA can scale well to various large-scale deep neural networks compared to existing state-of-the-art baselines. For the purpose of reproducibility, we release our tool on GitHub: \url{ https://github.com/TrustAI/PRoA}.

Federated learning (FL) hyper-parameters significantly affect the training overheads in terms of computation time, transmission time, computation load, and transmission load. However, the current practice of manually selecting FL hyper-parameters puts a high burden on FL practitioners since various applications prefer different training preferences. In this paper, we propose FedTune, an automatic FL hyper-parameter tuning algorithm tailored to applications' diverse system requirements of FL training. FedTune is lightweight and flexible, achieving 8.48%-26.75% improvement for different datasets compared to fixed FL hyper-parameters.

Federated learning (FL) aims to minimize the communication complexity of training a model over heterogeneous data distributed across many clients. A common approach is local methods, where clients take multiple optimization steps over local data before communicating with the server (e.g., FedAvg). Local methods can exploit similarity between clients' data. However, in existing analyses, this comes at the cost of slow convergence in terms of the dependence on the number of communication rounds R. On the other hand, global methods, where clients simply return a gradient vector in each round (e.g., SGD), converge faster in terms of R but fail to exploit the similarity between clients even when clients are homogeneous. We propose FedChain, an algorithmic framework that combines the strengths of local methods and global methods to achieve fast convergence in terms of R while leveraging the similarity between clients. Using FedChain, we instantiate algorithms that improve upon previously known rates in the general convex and PL settings, and are near-optimal (via an algorithm-independent lower bound that we show) for problems that satisfy strong convexity. Empirical results support this theoretical gain over existing methods.

There are several issues with the existing general machine translation or natural language generation evaluation metrics, and question-answering (QA) systems are indifferent in that context. To build robust QA systems, we need the ability to have equivalently robust evaluation systems to verify whether model predictions to questions are similar to ground-truth annotations. The ability to compare similarity based on semantics as opposed to pure string overlap is important to compare models fairly and to indicate more realistic acceptance criteria in real-life applications. We build upon the first to our knowledge paper that uses transformer-based model metrics to assess semantic answer similarity and achieve higher correlations to human judgement in the case of no lexical overlap. We propose cross-encoder augmented bi-encoder and BERTScore models for semantic answer similarity, trained on a new dataset consisting of name pairs of US-American public figures. As far as we are concerned, we provide the first dataset of co-referent name string pairs along with their similarities, which can be used for training.

Analysis and prediction of real-world complex systems of nonlinear dynamics relies largely on surrogate models. Reservoir computers (RC) have proven useful in replicating the climate of chaotic dynamics. The quality of surrogate models based on RCs is crucially dependent on judiciously determined optimal implementation that involves selecting optimal reservoir topology and hyperparameters. By systematically applying Bayesian hyperparameter optimization and using ensembles of reservoirs of various topology we show that the topology of linked reservoirs has no significance in forecasting dynamics of the chaotic Lorenz system. By simulations we show that simple reservoirs of unconnected nodes outperform reservoirs of linked reservoirs as surrogate models for the Lorenz system in different regimes. We give a derivation for why reservoirs of unconnected nodes have the maximum entropy and hence are optimal. We conclude that the performance of an RC is based on mere functional transformation, not in its dynamical properties as has been generally presumed. Hence, RC could be improved by including information on dynamics more strongly in the model.

Randomized smoothing is a recent technique that achieves state-of-art performance in training certifiably robust deep neural networks. While the smoothing family of distributions is often connected to the choice of the norm used for certification, the parameters of these distributions are always set as global hyper parameters independent from the input data on which a network is certified. In this work, we revisit Gaussian randomized smoothing and show that the variance of the Gaussian distribution can be optimized at each input so as to maximize the certification radius for the construction of the smooth classifier. Since the data dependent classifier does not directly enjoy sound certification with existing approaches, we propose a memory-enhanced data dependent smooth classifier that is certifiable by construction. This new approach is generic, parameter-free, and easy to implement. In fact, we show that our data dependent framework can be seamlessly incorporated into 3 randomized smoothing approaches, leading to consistent improved certified accuracy. When this framework is used in the training routine of these approaches followed by a data dependent certification, we achieve 9% and 6% improvement over the certified accuracy of the strongest baseline for a radius of 0.5 on CIFAR10 and ImageNet.

Auctions with partially-revealed information about items are broadly employed in real-world applications, but the underlying mechanisms have limited theoretical support. In this work, we study a machine learning formulation of these types of mechanisms, presenting algorithms that are no-regret from the buyer's perspective. Specifically, a buyer who wishes to maximize his utility interacts repeatedly with a platform over a series of $T$ rounds. In each round, a new item is drawn from an unknown distribution and the platform publishes a price together with incomplete, "masked" information about the item. The buyer then decides whether to purchase the item. We formalize this problem as an online learning task where the goal is to have low regret with respect to a myopic oracle that has perfect knowledge of the distribution over items and the seller's masking function. When the distribution over items is known to the buyer and the mask is a SimHash function mapping $\mathbb{R}^d$ to $\{0,1\}^{\ell}$, our algorithm has regret $\tilde O((Td\ell)^{1/2})$. In a fully agnostic setting when the mask is an arbitrary function mapping to a set of size $n$ and the prices are stochastic, our algorithm has regret $\tilde O((Tn)^{1/2})$.

Generative Adversarial Networks (GANs) learn an implicit generative model from data samples through a two-player game. In this paper, we study the existence of Nash equilibrium of the game which is consistent as the number of data samples grows to infinity. In a realizable setting where the goal is to estimate the ground-truth generator of a stationary Gaussian process, we show that the existence of consistent Nash equilibrium depends crucially on the choice of the discriminator family. The discriminator defined from second-order statistical moments can result in non-existence of Nash equilibrium, existence of consistent non-Nash equilibrium, or existence and uniqueness of consistent Nash equilibrium, depending on whether symmetry properties of the generator family are respected. We further study the local stability and global convergence of gradient descent-ascent methods towards consistent equilibrium.

A distinguishing characteristic of federated learning is that the (local) client data could have statistical heterogeneity. This heterogeneity has motivated the design of personalized learning, where individual (personalized) models are trained, through collaboration. There have been various personalization methods proposed in literature, with seemingly very different forms and methods ranging from use of a single global model for local regularization and model interpolation, to use of multiple global models for personalized clustering, etc. In this work, we begin with a generative framework that could potentially unify several different algorithms as well as suggest new algorithms. We apply our generative framework to personalized estimation, and connect it to the classical empirical Bayes' methodology. We develop private personalized estimation under this framework. We then use our generative framework for learning, which unifies several known personalized FL algorithms and also suggests new ones; we propose and study a new algorithm AdaPeD based on a Knowledge Distillation, which numerically outperforms several known algorithms. We also develop privacy for personalized learning methods with guarantees for user-level privacy and composition. We numerically evaluate the performance as well as the privacy for both the estimation and learning problems, demonstrating the advantages of our proposed methods.

Nowadays, intelligent highway traffic network is playing an important role in modern transportation infrastructures. A variable speed limit (VSL) system can be facilitated in the highway traffic network to provide useful and dynamic speed limit information for drivers to travel with enhanced safety. Such system is usually designed with a steady advisory speed in mind so that traffic can move smoothly when drivers follow the speed, rather than speeding up whenever there is a gap and slowing down at congestion. However, little attention has been given to the research of vehicles' behaviours when drivers left the road network governed by a VSL system, which may largely involve unexpected acceleration, deceleration and frequent lane changes, resulting in chaos for the subsequent highway road users. In this paper, we focus on the detection of traffic flow anomaly due to drivers' lane change intention on the highway traffic networks after a VSL system. More specifically, we apply graph modelling on the traffic flow data generated by a popular mobility simulator, SUMO, at road segment levels. We then evaluate the performance of lane changing detection using the proposed Lane-GNN scheme, an attention temporal graph convolutional neural network, and compare its performance with a temporal convolutional neural network (TCNN) as our baseline. Our experimental results show that the proposed Lane-GNN can detect drivers' lane change intention within 90 seconds with an accuracy of 99.42% under certain assumptions. Finally, some interpretation methods are applied to the trained models with a view to further illustrate our findings.

Eigenvector perturbation analysis plays a vital role in various data science applications. A large body of prior works, however, focused on establishing $\ell_{2}$ eigenvector perturbation bounds, which are often highly inadequate in addressing tasks that rely on fine-grained behavior of an eigenvector. This paper makes progress on this by studying the perturbation of linear functions of an unknown eigenvector. Focusing on two fundamental problems -- matrix denoising and principal component analysis -- in the presence of Gaussian noise, we develop a suite of statistical theory that characterizes the perturbation of arbitrary linear functions of an unknown eigenvector. In order to mitigate a non-negligible bias issue inherent to the natural ``plug-in'' estimator, we develop de-biased estimators that (1) achieve minimax lower bounds for a family of scenarios (modulo some logarithmic factor), and (2) can be computed in a data-driven manner without sample splitting. Noteworthily, the proposed estimators are nearly minimax optimal even when the associated eigen-gap is {\em substantially smaller} than what is required in prior statistical theory.

Recent years have witnessed an increasing interest in the correspondence between infinitely wide networks and Gaussian processes. Despite the effectiveness and elegance of the current neural network Gaussian process theory, to the best of our knowledge, all the neural network Gaussian processes are essentially induced by increasing width. However, in the era of deep learning, what concerns us more regarding a neural network is its depth as well as how depth impacts the behaviors of a network. Inspired by a width-depth symmetry consideration, we use a shortcut network to show that increasing the depth of a neural network can also give rise to a Gaussian process, which is a valuable addition to the existing theory and contributes to revealing the true picture of deep learning. Beyond the proposed Gaussian process by depth, we theoretically characterize its uniform tightness property and the smallest eigenvalue of the Gaussian process kernel. These characterizations can not only enhance our understanding of the proposed depth-induced Gaussian process but also pave the way for future applications. Lastly, we examine the performance of the proposed Gaussian process by regression experiments on two benchmark data sets.

We present PROSUB: PROgressive SUBsampling, a deep learning based, automated methodology that subsamples an oversampled data set (e.g. multi-channeled 3D images) with minimal loss of information. We build upon a recent dual-network approach that won the MICCAI MUlti-DIffusion (MUDI) quantitative MRI measurement sampling-reconstruction challenge, but suffers from deep learning training instability, by subsampling with a hard decision boundary. PROSUB uses the paradigm of recursive feature elimination (RFE) and progressively subsamples measurements during deep learning training, improving optimization stability. PROSUB also integrates a neural architecture search (NAS) paradigm, allowing the network architecture hyperparameters to respond to the subsampling process. We show PROSUB outperforms the winner of the MUDI MICCAI challenge, producing large improvements >18% MSE on the MUDI challenge sub-tasks and qualitative improvements on downstream processes useful for clinical applications. We also show the benefits of incorporating NAS and analyze the effect of PROSUB's components. As our method generalizes to other problems beyond MRI measurement selection-reconstruction, our code is https://github.com/sbb-gh/PROSUB

Optimal transport (OT) provides effective tools for comparing and mapping probability measures. We propose to leverage the flexibility of neural networks to learn an approximate optimal transport map. More precisely, we present a new and original method to address the problem of transporting a finite set of samples associated with a first underlying unknown distribution towards another finite set of samples drawn from another unknown distribution. We show that a particular instance of invertible neural networks, namely the normalizing flows, can be used to approximate the solution of this OT problem between a pair of empirical distributions. To this aim, we propose to relax the Monge formulation of OT by replacing the equality constraint on the push-forward measure by the minimization of the corresponding Wasserstein distance. The push-forward operator to be retrieved is then restricted to be a normalizing flow which is trained by optimizing the resulting cost function. This approach allows the transport map to be discretized as a composition of functions. Each of these functions is associated to one sub-flow of the network, whose output provides intermediate steps of the transport between the original and target measures. This discretization yields also a set of intermediate barycenters between the two measures of interest. Experiments conducted on toy examples as well as a challenging task of unsupervised translation demonstrate the interest of the proposed method. Finally, some experiments show that the proposed approach leads to a good approximation of the true OT.

Derivation of the probability density evolution provides invaluable insight into the behavior of many stochastic systems and their performance. However, for most real-time applica-tions, numerical determination of the probability density evolution is a formidable task. The latter is due to the required temporal and spatial discretization schemes that render most computational solutions prohibitive and impractical. In this respect, the development of an efficient computational surrogate model is of paramount importance. Recent studies on the physics-constrained networks show that a suitable surrogate can be achieved by encoding the physical insight into a deep neural network. To this aim, the present work introduces DeepPDEM which utilizes the concept of physics-informed networks to solve the evolution of the probability density via proposing a deep learning method. DeepPDEM learns the General Density Evolution Equation (GDEE) of stochastic structures. This approach paves the way for a mesh-free learning method that can solve the density evolution problem with-out prior simulation data. Moreover, it can also serve as an efficient surrogate for the solu-tion at any other spatiotemporal points within optimization schemes or real-time applica-tions. To demonstrate the potential applicability of the proposed framework, two network architectures with different activation functions as well as two optimizers are investigated. Numerical implementation on three different problems verifies the accuracy and efficacy of the proposed method.

In this paper, we present our vision of differentiable ML pipelines called DiffML to automate the construction of ML pipelines in an end-to-end fashion. The idea is that DiffML allows to jointly train not just the ML model itself but also the entire pipeline including data preprocessing steps, e.g., data cleaning, feature selection, etc. Our core idea is to formulate all pipeline steps in a differentiable way such that the entire pipeline can be trained using backpropagation. However, this is a non-trivial problem and opens up many new research questions. To show the feasibility of this direction, we demonstrate initial ideas and a general principle of how typical preprocessing steps such as data cleaning, feature selection and dataset selection can be formulated as differentiable programs and jointly learned with the ML model. Moreover, we discuss a research roadmap and core challenges that have to be systematically tackled to enable fully differentiable ML pipelines.

This paper presents an architecture for generating music for video games based on the Transformer deep learning model. The system generates music in various layers, following the standard layering strategy currently used by composers designing video game music. The music is adaptive to the psychological context of the player, according to the arousal-valence model. Our motivation is to customize music according to the player's tastes, who can select his preferred style of music through a set of training examples of music. We discuss current limitations and prospects for the future, such as collaborative and interactive control of the musical components.

Mechanistic models with differential equations are a key component of scientific applications of machine learning. Inference in such models is usually computationally demanding, because it involves repeatedly solving the differential equation. The main problem here is that the numerical solver is hard to combine with standard inference techniques. Recent work in probabilistic numerics has developed a new class of solvers for ordinary differential equations (ODEs) that phrase the solution process directly in terms of Bayesian filtering. We here show that this allows such methods to be combined very directly, with conceptual and numerical ease, with latent force models in the ODE itself. It then becomes possible to perform approximate Bayesian inference on the latent force as well as the ODE solution in a single, linear complexity pass of an extended Kalman filter / smoother - that is, at the cost of computing a single ODE solution. We demonstrate the expressiveness and performance of the algorithm by training, among others, a non-parametric SIRD model on data from the COVID-19 outbreak.

We propose an algorithm for non-stationary kernel bandits that does not require prior knowledge of the degree of non-stationarity. The algorithm follows randomized strategies obtained by solving optimization problems that balance exploration and exploitation. It adapts to non-stationarity by restarting when a change in the reward function is detected. Our algorithm enjoys a tighter dynamic regret bound than previous work on the non-stationary kernel bandit setting. Moreover, when applied to the non-stationary linear bandit setting by using a linear kernel, our algorithm is nearly minimax optimal, solving an open problem in the non-stationary linear bandit literature. We extend our algorithm to use a neural network for dynamically adapting the feature mapping to observed data. We prove a dynamic regret bound of the extension using the neural tangent kernel theory. We demonstrate empirically that our algorithm and the extension can adapt to varying degrees of non-stationarity.

Self-Supervised learning aims to eliminate the need for expensive annotation in graph representation learning, where graph contrastive learning (GCL) is trained with the self-supervision signals containing data-data pairs. These data-data pairs are generated with augmentation employing stochastic functions on the original graph. We argue that some features can be more critical than others depending on the downstream task, and applying stochastic function uniformly, will vandalize the influential features, leading to diminished accuracy. To fix this issue, we introduce a Feature Based Adaptive Augmentation (FebAA) approach, which identifies and preserves potentially influential features and corrupts the remaining ones. We implement FebAA as plug and play layer and use it with state-of-the-art Deep Graph Contrastive Learning (GRACE) and Bootstrapped Graph Latents (BGRL). We successfully improved the accuracy of GRACE and BGRL on eight graph representation learning's benchmark datasets.

Nonconvex-concave min-max problem arises in many machine learning applications including minimizing a pointwise maximum of a set of nonconvex functions and robust adversarial training of neural networks. A popular approach to solve this problem is the gradient descent-ascent (GDA) algorithm which unfortunately can exhibit oscillation in case of nonconvexity. In this paper, we introduce a "smoothing" scheme which can be combined with GDA to stabilize the oscillation and ensure convergence to a stationary solution. We prove that the stabilized GDA algorithm can achieve an $O(1/\epsilon^2)$ iteration complexity for minimizing the pointwise maximum of a finite collection of nonconvex functions. Moreover, the smoothed GDA algorithm achieves an $O(1/\epsilon^4)$ iteration complexity for general nonconvex-concave problems. Extensions of this stabilized GDA algorithm to multi-block cases are presented. To the best of our knowledge, this is the first algorithm to achieve $O(1/\epsilon^2)$ for a class of nonconvex-concave problem. We illustrate the practical efficiency of the stabilized GDA algorithm on robust training.

The use of Deep Reinforcement Learning (DRL) schemes has increased dramatically since their first introduction in 2015. Though uses in many different applications are being found they still have a problem with the lack of interpretability. This has bread a lack of understanding and trust in the use of DRL solutions from researchers and the general public. To solve this problem the field of explainable artificial intelligence (XAI) has emerged. This is a variety of different methods that look to open the DRL black boxes, they range from the use of interpretable symbolic decision trees to numerical methods like Shapley Values. This review looks at which methods are being used and what applications they are being used. This is done to identify which models are the best suited to each application or if a method is being underutilised.

We study certified robustness of machine learning classifiers against adversarial perturbations. In particular, we propose the first universally approximated certified robustness (UniCR) framework, which can approximate the robustness certification of any input on any classifier against any $\ell_p$ perturbations with noise generated by any continuous probability distribution. Compared with the state-of-the-art certified defenses, UniCR provides many significant benefits: (1) the first universal robustness certification framework for the above 4 'any's; (2) automatic robustness certification that avoids case-by-case analysis, (3) tightness validation of certified robustness, and (4) optimality validation of noise distributions used by randomized smoothing. We conduct extensive experiments to validate the above benefits of UniCR and the advantages of UniCR over state-of-the-art certified defenses against $\ell_p$ perturbations.

Along with the flourish of the information age, massive amounts of data are generated day by day. Due to the large-scale and high-dimensional characteristics of these data, it is often difficult to achieve better decision-making in practical applications. Therefore, an efficient big data analytics method is urgently needed. For feature engineering, feature selection seems to be an important research content in which is anticipated to select "excellent" features from candidate ones. Different functions can be realized through feature selection, such as dimensionality reduction, model effect improvement, and model performance improvement. In many classification tasks, researchers found that data seem to be usually close to each other if they are from the same class; thus, local compactness is of great importance for the evaluation of a feature. In this manuscript, we propose a fast unsupervised feature selection method, named as, Compactness Score (CSUFS), to select desired features. To demonstrate the efficiency and accuracy, several data sets are chosen with extensive experiments being performed. Later, the effectiveness and superiority of our method are revealed through addressing clustering tasks. Here, the performance is indicated by several well-known evaluation metrics, while the efficiency is reflected by the corresponding running time. As revealed by the simulation results, our proposed algorithm seems to be more accurate and efficient compared with existing algorithms.

In recent years, a great emphasis has been put on engineering the acoustic signature of vehicles that represents the overall comfort level for passengers. Due to highly uncertain behavior of production cars, probabilistic metamodels or surrogates can be useful to estimate the NVH dispersion and assess different NVH risks. These metamodels follow physical behaviors and shall aid as a design space exploration tool during the early stage design process to support the NVH optimization. The measurement databases constitute different noise paths such as aerodynamic noise (wind-tunnel test), tire-pavement interaction noise (rolling noise), and noise due to electric motors (whining noise). This research work proposes a global NVH metamodeling technique for broadband noises such as aerodynamic and rolling noises exploiting the Bayesian framework that takes into account the prior (domain-expert) knowledge about complex physical mechanisms. Generalized additive models (GAMs) with polynomials and Gaussian basis functions are used to model the dependency of sound pressure level (SPL) on predictor variables. Moreover, parametric bootstrap algorithm based on data-generating mechanism using the point estimates is used to estimate the dispersion in unknown parameters. Probabilistic modelling is carried out using an open-source library PyMC3 that utilizes No-U-Turn sampler (NUTS) and the developed models are validated using Cross-Validation technique.

Near out-of-distribution detection (OODD) aims at discriminating semantically similar data points without the supervision required for classification. This paper puts forward an OODD use case for radar targets detection extensible to other kinds of sensors and detection scenarios. We emphasize the relevance of OODD and its specific supervision requirements for the detection of a multimodal, diverse targets class among other similar radar targets and clutter in real-life critical systems. We propose a comparison of deep and non-deep OODD methods on simulated low-resolution pulse radar micro-Doppler signatures, considering both a spectral and a covariance matrix input representation. The covariance representation aims at estimating whether dedicated second-order processing is appropriate to discriminate signatures. The potential contributions of labeled anomalies in training, self-supervised learning, contrastive learning insights and innovative training losses are discussed, and the impact of training set contamination caused by mislabelling is investigated.

Nowadays, systems based on machine learning (ML) are widely used in different domains. Given their popularity, ML models have become targets for various attacks. As a result, research at the intersection of security and privacy, and ML has flourished. The research community has been exploring the attack vectors and potential mitigations separately. However, practitioners will likely need to deploy defences against several threats simultaneously. A solution that is optimal for a specific concern may interact negatively with solutions intended to address other concerns. In this work, we explore the potential for conflicting interactions between different solutions that enhance the security/privacy of ML-base systems. We focus on model and data ownership; exploring how ownership verification techniques interact with other ML security/privacy techniques like differentially private training, and robustness against model evasion. We provide a framework, and conduct systematic analysis of pairwise interactions. We show that many pairs are incompatible. Where possible, we provide relaxations to the hyperparameters or the techniques themselves that allow for the simultaneous deployment. Lastly, we discuss the implications and provide guidelines for future work.

Non-intrusive load monitoring (NILM) is the task of disaggregating the total power consumption into its individual sub-components. Over the years, signal processing and machine learning algorithms have been combined to achieve this. A lot of publications and extensive research works are performed on energy disaggregation or NILM for the state-of-the-art methods to reach on the desirable performance. The initial interest of the scientific community to formulate and describe mathematically the NILM problem using machine learning tools has now shifted into a more practical NILM. Nowadays, we are in the mature NILM period where there is an attempt for NILM to be applied in real-life application scenarios. Thus, complexity of the algorithms, transferability, reliability, practicality and in general trustworthiness are the main issues of interest. This review narrows the gap between the early immature NILM era and the mature one. In particular, the paper provides a comprehensive literature review of the NILM methods for residential appliances only. The paper analyzes, summarizes and presents the outcomes of a large number of recently published scholarly articles. Also, the paper discusses the highlights of these methods and introduces the research dilemmas that should be taken into consideration by researchers to apply NILM methods. Finally, we show the need for transferring the traditional disaggregation models into a practical and trustworthy framework.

Few-shot classification (FSC) requires training models using a few (typically one to five) data points per class. Meta learning has proven to be able to learn a parametrized model for FSC by training on various other classification tasks. In this work, we propose PLATINUM (semi-suPervised modeL Agnostic meTa-learnIng usiNg sUbmodular Mutual information), a novel semi-supervised model agnostic meta-learning framework that uses the submodular mutual information (SMI) functions to boost the performance of FSC. PLATINUM leverages unlabeled data in the inner and outer loop using SMI functions during meta-training and obtains richer meta-learned parameterizations for meta-test. We study the performance of PLATINUM in two scenarios - 1) where the unlabeled data points belong to the same set of classes as the labeled set of a certain episode, and 2) where there exist out-of-distribution classes that do not belong to the labeled set. We evaluate our method on various settings on the miniImageNet, tieredImageNet and Fewshot-CIFAR100 datasets. Our experiments show that PLATINUM outperforms MAML and semi-supervised approaches like pseduo-labeling for semi-supervised FSC, especially for small ratio of labeled examples per class.

This work introduces a novel knowledge distillation framework for classification tasks where information on existing subclasses is available and taken into consideration. In classification tasks with a small number of classes or binary detection (two classes) the amount of information transferred from the teacher to the student network is restricted, thus limiting the utility of knowledge distillation. Performance can be improved by leveraging information about possible subclasses within the available classes in the classification task. To that end, we propose the so-called Subclass Knowledge Distillation (SKD) framework, which is the process of transferring the subclasses' prediction knowledge from a large teacher model into a smaller student one. Through SKD, additional meaningful information which is not in the teacher's class logits but exists in subclasses (e.g., similarities inside classes) will be conveyed to the student and boost its performance. Mathematically, we measure how many extra information bits the teacher can provide for the student via SKD framework. The framework developed is evaluated in clinical application, namely colorectal polyp binary classification. In this application, clinician-provided annotations are used to define subclasses based on the annotation label's variability in a curriculum style of learning. A lightweight, low complexity student trained with the proposed framework achieves an F1-score of 85.05%, an improvement of 2.14% and 1.49% gain over the student that trains without and with conventional knowledge distillation, respectively. These results show that the extra subclasses' knowledge (i.e., 0.4656 label bits per training sample in our experiment) can provide more information about the teacher generalization, and therefore SKD can benefit from using more information to increase the student performance.

As the number of video content has mushroomed in recent years, automatic video summarization has come useful when we want to just peek at the content of the video. However, there are two underlying limitations in generic video summarization task. First, most previous approaches read in just visual features as input, leaving other modality features behind. Second, existing datasets for generic video summarization are relatively insufficient to train a caption generator and multimodal feature extractors. To address these two problems, this paper proposes the Multimodal Frame-Scoring Transformer (MFST) framework exploiting visual, text and audio features and scoring a video with respect to frames. Our MFST framework first extracts each modality features (visual-text-audio) using pretrained encoders. Then, MFST trains the multimodal frame-scoring transformer that uses video-text-audio representations as inputs and predicts frame-level scores. Our extensive experiments with previous models and ablation studies on TVSum and SumMe datasets demonstrate the effectiveness and superiority of our proposed method.

Traditional survey methods for finding surface resistivity are time-consuming and labor intensive. Very few studies have focused on finding the resistivity/conductivity using remote sensing data and deep learning techniques. In this line of work, we assessed the correlation between surface resistivity and Synthetic Aperture Radar (SAR) by applying various deep learning methods and tested our hypothesis in the Coso Geothermal Area, USA. For detecting the resistivity, L-band full polarimetric SAR data acquired by UAVSAR were used, and MT (Magnetotellurics) inverted resistivity data of the area were used as the ground truth. We conducted experiments to compare various deep learning architectures and suggest the use of Dual Input UNet (DI-UNet) architecture. DI-UNet uses a deep learning architecture to predict the resistivity using full polarimetric SAR data by promising a quick survey addition to the traditional method. Our proposed approach accomplished improved outcomes for the mapping of MT resistivity from SAR data.

Federated learning (FL) provides autonomy and privacy by design to participating peers, who cooperatively build a machine learning (ML) model while keeping their private data in their devices. However, that same autonomy opens the door for malicious peers to poison the model by conducting either untargeted or targeted poisoning attacks. The label-flipping (LF) attack is a targeted poisoning attack where the attackers poison their training data by flipping the labels of some examples from one class (i.e., the source class) to another (i.e., the target class). Unfortunately, this attack is easy to perform and hard to detect and it negatively impacts on the performance of the global model. Existing defenses against LF are limited by assumptions on the distribution of the peers' data and/or do not perform well with high-dimensional models. In this paper, we deeply investigate the LF attack behavior and find that the contradicting objectives of attackers and honest peers on the source class examples are reflected in the parameter gradients corresponding to the neurons of the source and target classes in the output layer, making those gradients good discriminative features for the attack detection. Accordingly, we propose a novel defense that first dynamically extracts those gradients from the peers' local updates, and then clusters the extracted gradients, analyzes the resulting clusters and filters out potential bad updates before model aggregation. Extensive empirical analysis on three data sets shows the proposed defense's effectiveness against the LF attack regardless of the data distribution or model dimensionality. Also, the proposed defense outperforms several state-of-the-art defenses by offering lower test error, higher overall accuracy, higher source class accuracy, lower attack success rate, and higher stability of the source class accuracy.

Deep learning models are nowadays broadly deployed to solve an incredibly large variety of tasks. However, little attention has been devoted to connected legal aspects. In 2016, the European Union approved the General Data Protection Regulation which entered into force in 2018. Its main rationale was to protect the privacy and data protection of its citizens by the way of operating of the so-called "Data Economy". As data is the fuel of modern Artificial Intelligence, it is argued that the GDPR can be partly applicable to a series of algorithmic decision making tasks before a more structured AI Regulation enters into force. In the meantime, AI should not allow undesired information leakage deviating from the purpose for which is created. In this work we propose DisP, an approach for deep learning models disentangling the information related to some classes we desire to keep private, from the data processed by AI. In particular, DisP is a regularization strategy de-correlating the features belonging to the same private class at training time, hiding the information of private classes membership. Our experiments on state-of-the-art deep learning models show the effectiveness of DisP, minimizing the risk of extraction for the classes we desire to keep private.

Despite the promising results achieved, state-of-the-art interactive reinforcement learning schemes rely on passively receiving supervision signals from advisor experts, in the form of either continuous monitoring or pre-defined rules, which inevitably result in a cumbersome and expensive learning process. In this paper, we introduce a novel initiative advisor-in-the-loop actor-critic framework, termed as Ask-AC, that replaces the unilateral advisor-guidance mechanism with a bidirectional learner-initiative one, and thereby enables a customized and efficacious message exchange between learner and advisor. At the heart of Ask-AC are two complementary components, namely action requester and adaptive state selector, that can be readily incorporated into various discrete actor-critic architectures. The former component allows the agent to initiatively seek advisor intervention in the presence of uncertain states, while the latter identifies the unstable states potentially missed by the former especially when environment changes, and then learns to promote the ask action on such states. Experimental results on both stationary and non-stationary environments and across different actor-critic backbones demonstrate that the proposed framework significantly improves the learning efficiency of the agent, and achieves the performances on par with those obtained by continuous advisor monitoring.

The traditional approach to distributed machine learning is to adapt learning algorithms to the network, e.g., reducing updates to curb overhead. Networks based on intelligent edge, instead, make it possible to follow the opposite approach, i.e., to define the logical network topology em around the learning task to perform, so as to meet the desired learning performance. In this paper, we propose a system model that captures such aspects in the context of supervised machine learning, accounting for both learning nodes (that perform computations) and information nodes (that provide data). We then formulate the problem of selecting (i) which learning and information nodes should cooperate to complete the learning task, and (ii) the number of iterations to perform, in order to minimize the learning cost while meeting the target prediction error and execution time. After proving important properties of the above problem, we devise an algorithm, named DoubleClimb, that can find a 1+1/|I|-competitive solution (with I being the set of information nodes), with cubic worst-case complexity. Our performance evaluation, leveraging a real-world network topology and considering both classification and regression tasks, also shows that DoubleClimb closely matches the optimum, outperforming state-of-the-art alternatives.  ( 3 min )

Bagging and boosting are two popular ensemble methods in machine learning (ML) that produce many individual decision trees. Due to the inherent ensemble characteristic of these methods, they typically outperform single decision trees or other ML models in predictive performance. However, numerous decision paths are generated for each decision tree, increasing the overall complexity of the model and hindering its use in domains that require trustworthy and explainable decisions, such as finance, social care, and health care. Thus, the interpretability of bagging and boosting algorithms, such as random forest and adaptive boosting, reduces as the number of decisions rises. In this paper, we propose a visual analytics tool that aims to assist users in extracting decisions from such ML models via a thorough visual inspection workflow that includes selecting a set of robust and diverse models (originating from different ensemble learning algorithms), choosing important features according to their global contribution, and deciding which decisions are essential for global explanation (or locally, for specific cases). The outcome is a final decision based on the class agreement of several models and the explored manual decisions exported by users. We evaluated the applicability and effectiveness of VisRuler via a use case, a usage scenario, and a user study. The evaluation revealed that most users managed to successfully use our system to explore decision rules visually, performing the proposed tasks and answering the given questions in a satisfying way.

Existing computer vision systems can compete with humans in understanding the visible parts of objects, but still fall far short of humans when it comes to depicting the invisible parts of partially occluded objects. Image amodal completion aims to equip computers with human-like amodal completion functions to understand an intact object despite it being partially occluded. The main purpose of this survey is to provide an intuitive understanding of the research hotspots, key technologies and future trends in the field of image amodal completion. Firstly, we present a comprehensive review of the latest literature in this emerging field, exploring three key tasks in image amodal completion, including amodal shape completion, amodal appearance completion, and order perception. Then we examine popular datasets related to image amodal completion along with their common data collection methods and evaluation metrics. Finally, we discuss real-world applications and future research directions for image amodal completion, facilitating the reader's understanding of the challenges of existing technologies and upcoming research trends.  ( 2 min )

Inserting an SVD meta-layer into neural networks is prone to make the covariance ill-conditioned, which could harm the model in the training stability and generalization abilities. In this paper, we systematically study how to improve the covariance conditioning by enforcing orthogonality to the Pre-SVD layer. Existing orthogonal treatments on the weights are first investigated. However, these techniques can improve the conditioning but would hurt the performance. To avoid such a side effect, we propose the Nearest Orthogonal Gradient (NOG) and Optimal Learning Rate (OLR). The effectiveness of our methods is validated in two applications: decorrelated Batch Normalization (BN) and Global Covariance Pooling (GCP). Extensive experiments on visual recognition demonstrate that our methods can simultaneously improve the covariance conditioning and generalization. Moreover, the combinations with orthogonal weight can further boost the performances.  ( 2 min )

Solving differential equations efficiently and accurately sits at the heart of progress in many areas of scientific research, from classical dynamical systems to quantum mechanics. There is a surge of interest in using Physics-Informed Neural Networks (PINNs) to tackle such problems as they provide numerous benefits over traditional numerical approaches. Despite their potential benefits for solving differential equations, transfer learning has been under explored. In this study, we present a general framework for transfer learning PINNs that results in one-shot inference for linear systems of both ordinary and partial differential equations. This means that highly accurate solutions to many unknown differential equations can be obtained instantaneously without retraining an entire network. We demonstrate the efficacy of the proposed deep learning approach by solving several real-world problems, such as first- and second-order linear ordinary equations, the Poisson equation, and the time-dependent Schrodinger complex-value partial differential equation.

Positive-unlabeled (PU) learning deals with binary classification problems when only positive (P) and unlabeled (U) data are available. A lot of PU methods based on linear models and neural networks have been proposed; however, there still lacks study on how the theoretically sound boosting-style algorithms could work with P and U data. Considering that in some scenarios when neural networks cannot perform as good as boosting algorithms even with fully-supervised data, we propose a novel boosting algorithm for PU learning: Ada-PU, which compares against neural networks. Ada-PU follows the general procedure of AdaBoost while two different distributions of P data are maintained and updated. After a weak classifier is learned on the newly updated distribution, the corresponding combining weight for the final ensemble is estimated using only PU data. We demonstrated that with a smaller set of base classifiers, the proposed method is guaranteed to keep the theoretical properties of boosting algorithms. In experiments, we showed that Ada-PU outperforms neural networks on benchmark PU datasets. We also study a real-world dataset UNSW-NB15 in cyber security and demonstrated that Ada-PU has superior performance for malicious activity detection.

Graph embedding, representing local and global neighborhood information by numerical vectors, is a crucial part of the mathematical modeling of a wide range of real-world systems. Among the embedding algorithms, random walk-based algorithms have proven to be very successful. These algorithms collect information by creating numerous random walks with a redefined number of steps. Creating random walks is the most demanding part of the embedding process. The computation demand increases with the size of the network. Moreover, for real-world networks, considering all nodes on the same footing, the abundance of low-degree nodes creates an imbalanced data problem. In this work, a computationally less intensive and node connectivity aware uniform sampling method is proposed. In the proposed method, the number of random walks is created proportionally with the degree of the node. The advantages of the proposed algorithm become more enhanced when the algorithm is applied to large graphs. A comparative study by using two networks namely CORA and CiteSeer is presented. Comparing with the fixed number of walks case, the proposed method requires 50% less computational effort to reach the same accuracy for node classification and link prediction calculations.

Machine learning based decision making systems applied in safety critical areas require reliable high certainty predictions. For this purpose, the system can be extended by an reject option which allows the system to reject inputs where only a prediction with an unacceptably low certainty would be possible. While being able to reject uncertain samples is important, it is also of importance to be able to explain why a particular sample was rejected. With the ongoing rise of eXplainable AI (XAI), a lot of explanation methodologies for machine learning based systems have been developed -- explaining reject options, however, is still a novel field where only very little prior work exists. In this work, we propose to explain rejects by semifactual explanations, an instance of example-based explanation methods, which them self have not been widely considered in the XAI community yet. We propose a conceptual modeling of semifactual explanations for arbitrary reject options and empirically evaluate a specific implementation on a conformal prediction based reject option.

Utilizing text-only data with an external language model (ELM) in end-to-end RNN-Transducer (RNN-T) for speech recognition is challenging. Recently, a class of methods such as density ratio (DR) and internal language model estimation (ILME) have been developed, outperforming the classic shallow fusion (SF) method. The basic idea behind these methods is that RNN-T posterior should first subtract the implicitly learned internal language model (ILM) prior, in order to integrate the ELM. While recent studies suggest that RNN-T only learns some low-order language model information, the DR method uses a well-trained neural language model with full context, which may be inappropriate for the estimation of ILM and deteriorate the integration performance. Based on the DR method, we propose a low-order density ratio method (LODR) by replacing the estimation with a low-order weak language model. Extensive empirical experiments are conducted on both in-domain and cross-domain scenarios on English LibriSpeech & Tedlium-2 and Chinese WenetSpeech & AISHELL-1 datasets. It is shown that LODR consistently outperforms SF in all tasks, while performing generally close to ILME and better than DR in most tests.

Medical imaging, including MRI, CT, and Ultrasound, plays a vital role in clinical decisions. Accurate segmentation is essential to measure the structure of interest from the image. However, manual segmentation is highly operator-dependent, which leads to high inter and intra-variability of quantitative measurements. In this paper, we explore the feasibility that Bayesian predictive distribution parameterized by deep neural networks can capture the clinicians' inter-intra variability. By exploring and analyzing recently emerged approximate inference schemes, we evaluate whether approximate Bayesian deep learning with the posterior over segmentations can learn inter-intra rater variability both in segmentation and clinical measurements. The experiments are performed with two different imaging modalities: MRI and ultrasound. We empirically demonstrated that Bayesian predictive distribution parameterized by deep neural networks could approximate the clinicians' inter-intra variability. We show a new perspective in analyzing medical images quantitatively by providing clinical measurement uncertainty.

Neural networks have become popular in many fields of science since they serve as promising, reliable and powerful tools. In this work, we study the effect of data augmentation on the predictive power of neural network models for nuclear physics data. We present two different data augmentation techniques, and we conduct a detailed analysis in terms of different depths, optimizers, activation functions and random seed values to show the success and robustness of the model. Using the experimental uncertainties for data augmentation for the first time, the size of the training data set is artificially boosted and the changes in the root-mean-square error between the model predictions on the test set and the experimental data are investigated. Our results show that the data augmentation decreases the prediction errors, stabilizes the model and prevents overfitting. The extrapolation capabilities of the MLP models are also tested for newly measured nuclei in AME2020 mass table, and it is shown that the predictions are significantly improved by using data augmentation.

In recent years, an abundance of feature attribution methods for explaining neural networks have been developed. Especially in the field of computer vision, many methods for generating saliency maps providing pixel attributions exist. However, their explanations often contradict each other and it is not clear which explanation to trust. A natural solution to this problem is the aggregation of multiple explanations. We present and compare different pixel-based aggregation schemes with the goal of generating a new explanation, whose fidelity to the model's decision is higher than each individual explanation. Using methods from the field of Bayesian Optimization, we incorporate the variance between the individual explanations into the aggregation process. Additionally, we analyze the effect of multiple normalization techniques on ensemble aggregation.

A deep reinforcement learning approach is applied, for the first time, to solve the routing, modulation, spectrum and core allocation (RMSCA) problem in dynamic multicore fiber elastic optical networks (MCF-EONs). To do so, a new environment - compatible with OpenAI's Gym - was designed and implemented to emulate the operation of MCF-EONs. The new environment processes the agent actions (selection of route, core and spectrum slot) by considering the network state and physical-layer-related aspects. The latter includes the available modulation formats and their reach and the inter-core crosstalk (XT), an MCF-related impairment. If the resulting quality of the signal is acceptable, the environment allocates the resources selected by the agent. After processing the agent's action, the environment is configured to give the agent a numerical reward and information about the new network state. The blocking performance of four different agents was compared through simulation to 3 baseline heuristics used in MCF-EONs. Results obtained for the NSFNet and COST239 network topologies show that the best-performing agent achieves, on average, up to a four-times decrease in blocking probability concerning the best-performing baseline heuristic methods.  ( 2 min )

Content-addressable memory (CAM) networks, so-called because stored items can be recalled by partial or corrupted versions of the items, exhibit near-perfect recall of a small number of information-dense patterns below capacity and a 'memory cliff' beyond, such that inserting a single additional pattern results in catastrophic loss of all stored patterns. We propose a novel CAM architecture, Memory Scaffold with Heteroassociation (MESH), that factorizes the problems of internal attractor dynamics and association with external content to generate a CAM continuum without a memory cliff: Small numbers of patterns are stored with complete information recovery matching standard CAMs, while inserting more patterns still results in partial recall of every pattern, with a graceful trade-off between pattern number and pattern richness. Motivated by the architecture of the Entorhinal-Hippocampal memory circuit in the brain, MESH is a tripartite architecture with pairwise interactions that uses a predetermined set of internally stabilized states together with heteroassociation between the internal states and arbitrary external patterns. We show analytically and experimentally that for any number of stored patterns, MESH nearly saturates the total information bound (given by the number of synapses) for CAM networks, outperforming all existing CAM models.

Traditionally, federated learning (FL) aims to train a single global model while collaboratively using multiple clients and a server. Two natural challenges that FL algorithms face are heterogeneity in data across clients and collaboration of clients with {\em diverse resources}. In this work, we introduce a \textit{quantized} and \textit{personalized} FL algorithm QuPeD that facilitates collective (personalized model compression) training via \textit{knowledge distillation} (KD) among clients who have access to heterogeneous data and resources. For personalization, we allow clients to learn \textit{compressed personalized models} with different quantization parameters and model dimensions/structures. Towards this, first we propose an algorithm for learning quantized models through a relaxed optimization problem, where quantization values are also optimized over. When each client participating in the (federated) learning process has different requirements for the compressed model (both in model dimension and precision), we formulate a compressed personalization framework by introducing knowledge distillation loss for local client objectives collaborating through a global model. We develop an alternating proximal gradient update for solving this compressed personalization problem, and analyze its convergence properties. Numerically, we validate that QuPeD outperforms competing personalized FL methods, FedAvg, and local training of clients in various heterogeneous settings.

Multi-label classification is a challenging task, particularly in domains where the number of labels to be predicted is large. Deep neural networks are often effective at multi-label classification of images and textual data. When dealing with tabular data, however, conventional machine learning algorithms, such as tree ensembles, appear to outperform competition. Random forest, being a popular ensemble algorithm, has found use in a wide range of real-world problems. Such problems include fraud detection in the financial domain, crime hotspot detection in the legal sector, and in the biomedical field, disease probability prediction when patient records are accessible. Since they have an impact on people's lives, these domains usually require decision-making systems to be explainable. Random Forest falls short on this property, especially when a large number of tree predictors are used. This issue was addressed in a recent research named LionForests, regarding single label classification and regression. In this work, we adapt this technique to multi-label classification problems, by employing three different strategies regarding the labels that the explanation covers. Finally, we provide a set of qualitative and quantitative experiments to assess the efficacy of this approach.

We introduce a method for deterministic decoupling of global features and show its applicability to improve data analysis performance, as well as to open new venues for feature transfer. We propose a new formalism that is based on defining transformations on submanifolds, by following trajectories along the features gradients. Through these transformations we define a normalization that, we demonstrate, allows for decoupling differentiable features. By applying this to sampling moments, we obtain a quasi-analytic solution for the orthokurtosis, a normalized version of the kurtosis that is not just decoupled from mean and variance, but also from skewness. We apply this method in the original data domain and at the output of a filter bank to regression and classification problems based on global descriptors, obtaining a consistent and significant improvement in performance as compared to using classical (non-decoupled) descriptors.  ( 2 min )

We consider the problem of sequential evaluation, in which an evaluator observes candidates in a sequence and assigns scores to these candidates in an online, irrevocable fashion. Motivated by the psychology literature that has studied sequential bias in such settings -- namely, dependencies between the evaluation outcome and the order in which the candidates appear -- we propose a natural model for the evaluator's rating process that captures the lack of calibration inherent to such a task. We conduct crowdsourcing experiments to demonstrate various facets of our model. We then proceed to study how to correct sequential bias under our model by posing this as a statistical inference problem. We propose a near-linear time, online algorithm for this task and prove guarantees in terms of two canonical ranking metrics. We also prove that our algorithm is information theoretically optimal, by establishing matching lower bounds in both metrics. Finally, we show that our algorithm outperforms the de facto method of using the rankings induced by the reported scores.

Understanding the semantic meaning of tabular data requires Entity Linking (EL), in order to associate each cell value to a real-world entity in a Knowledge Base (KB). In this work, we focus on end-to-end solutions for EL on tabular data that do not rely on fact lookup in the target KB. Tabular data contains heterogeneous and sparse context, including column headers, cell values and table captions. We experiment with various models to generate a vector representation for each cell value to be linked. Our results show that it is critical to apply an attention mechanism as well as an attention mask, so that the model can only attend to the most relevant context and avoid information dilution. The most relevant context includes: same-row cells, same-column cells, headers and caption. Computational complexity, however, grows quadratically with the size of tabular data for such a complex model. We achieve constant memory usage by introducing a Tabular Entity Linking Lite model (TELL ) that generates vector representation for a cell based only on its value, the table headers and the table caption. TELL achieves 80.8% accuracy on Wikipedia tables, which is only 0.1% lower than the state-of-the-art model with quadratic memory usage.  ( 2 min )

A common sales strategy involves having account executives (AEs) actively reach out and contact potential customers. However, not all contact attempts have a positive effect: some attempts do not change customer decisions, while others might even interfere with the desired outcome. In this work we propose using causal inference to estimate the effect of contacting each potential customer and setting the contact policy accordingly. We demonstrate this approach on data from Worthy.com, an online jewelry marketplace. We examined the Worthy business process to identify relevant decisions and outcomes, and formalized assumptions on how they were made. Using causal tools, we selected a decision point where improving AE contact activity appeared to be promising. We then generated a personalized policy and recommended reaching out only to customers for whom it would be beneficial. Finally, we validated the results in an A\B test over a 3-month period, resulting in an increase in item delivery rate of the targeted population by 22% (p-value=0.026). This policy is now being used on an ongoing basis.

The mass distribution of dark matter haloes is the result of the hierarchical growth of initial density perturbations through mass accretion and mergers. We use an interpretable machine-learning framework to provide physical insights into the origin of the spherically-averaged mass profile of dark matter haloes. We train a gradient-boosted-trees algorithm to predict the final mass profiles of cluster-sized haloes, and measure the importance of the different inputs provided to the algorithm. We find two primary scales in the initial conditions (ICs) that impact the final mass profile: the density at approximately the scale of the haloes' Lagrangian patch $R_L$ ($R\sim 0.7\, R_L$) and that in the large-scale environment ($R\sim 1.7~R_L$). The model also identifies three primary time-scales in the halo assembly history that affect the final profile: (i) the formation time of the virialized, collapsed material inside the halo, (ii) the dynamical time, which captures the dynamically unrelaxed, infalling component of the halo over its first orbit, (iii) a third, most recent time-scale, which captures the impact on the outer profile of recent massive merger events. While the inner profile retains memory of the ICs, this information alone is insufficient to yield accurate predictions for the outer profile. As we add information about the haloes' mass accretion history, we find a significant improvement in the predicted profiles at all radii. Our machine-learning framework provides novel insights into the role of the ICs and the mass assembly history in determining the final mass profile of cluster-sized haloes.

The standard supervised learning paradigm works effectively when training data shares the same distribution as the upcoming testing samples. However, this assumption is often violated in real-world applications, especially when testing data appear in an online fashion. In this paper, we formulate and investigate the problem of online label shift (OLaS): the learner trains an initial model from the labeled offline data and then deploys it to an unlabeled online environment where the underlying label distribution changes over time but the label-conditional density does not. The non-stationarity nature and the lack of supervision make the problem challenging to be tackled. To address the difficulty, we construct a new unbiased risk estimator that utilizes the unlabeled data, which exhibits many benign properties albeit with potential non-convexity. Building upon that, we propose novel online ensemble algorithms to deal with the non-stationarity of the environments. Our approach enjoys optimal dynamic regret, indicating that the performance is competitive with a clairvoyant who knows the online environments in hindsight and then chooses the best decision for each round. The obtained dynamic regret bound scales with the intensity and pattern of label distribution shift, hence exhibiting the adaptivity in the OLaS problem. Extensive experiments are conducted to validate the effectiveness and support our theoretical findings.  ( 2 min )

We consider minimizing a twice-differentiable, $L$-smooth, and $\mu$-strongly convex objective $\phi$ over an $n\times n$ positive semidefinite matrix $M\succeq0$, under the assumption that the minimizer $M^{\star}$ has low rank $r^{\star}\ll n$. Following the Burer--Monteiro approach, we instead minimize the nonconvex objective $f(X)=\phi(XX^{T})$ over a factor matrix $X$ of size $n\times r$. This substantially reduces the number of variables from $O(n^{2})$ to as few as $O(n)$ and also enforces positive semidefiniteness for free, but at the cost of giving up the convexity of the original problem. In this paper, we prove that if the search rank $r\ge r^{\star}$ is overparameterized by a constant factor with respect to the true rank $r^{\star}$, namely as in $r>\frac{1}{4}(L/\mu-1)^{2}r^{\star}$, then despite nonconvexity, local optimization is guaranteed to globally converge from any initial point to the global optimum. This significantly improves upon a previous rank overparameterization threshold of $r\ge n$, which is known to be sharp if $\phi$ is allowed to be nonsmooth and/or non-strongly convex, but would increase the number of variables back up to $O(n^{2})$. Conversely, without rank overparameterization, we prove that such a global guarantee is possible if and only if $\phi$ is almost perfectly conditioned, with a condition number of $L/\mu<3$. Therefore, we conclude that a small amount of overparameterization can lead to large improvements in theoretical guarantees for the nonconvex Burer--Monteiro factorization.  ( 3 min )

We propose a novel theoretical framework of analysis for Generative Adversarial Networks (GANs). We reveal a fundamental flaw of previous analyses which, by incorrectly modeling GANs' training scheme, are subject to ill-defined discriminator gradients. We overcome this issue which impedes a principled study of GAN training, solving it within our framework by taking into account the discriminator's architecture. To this end, we leverage the theory of infinite-width neural networks for the discriminator via its Neural Tangent Kernel. We characterize the trained discriminator for a wide range of losses and establish general differentiability properties of the network. From this, we derive new insights about the convergence of the generated distribution, advancing our understanding of GANs' training dynamics. We empirically corroborate these results via an analysis toolkit based on our framework, unveiling intuitions that are consistent with GAN practice.  ( 3 min )

Finding Nash equilibrial policies for two-player differential games requires solving Hamilton-Jacobi-Isaacs PDEs. Recent studies achieved success in circumventing the curse of dimensionality in solving such PDEs with underlying applications to human-robot interactions (HRI), by adopting self-supervised (physics-informed) neural networks as universal value approximators. This paper extends from previous SOTA on zero-sum games with continuous values to general-sum games with discontinuous values, where the discontinuity is caused by that of the players' losses. We show that due to its lack of convergence proof and generalization analysis on discontinuous losses, the existing self-supervised learning technique fails to generalize and raises safety concerns in an autonomous driving application. Our solution is to first pre-train the value network on supervised Nash equilibria, and then refine it by minimizing a loss that combines the supervised data with the PDE and boundary conditions. Importantly, the demonstrated advantage of the proposed learning method against purely supervised and self-supervised approaches requires careful choice of the neural activation function: Among $\texttt{relu}$, $\texttt{sin}$, and $\texttt{tanh}$, we show that $\texttt{tanh}$ is the only choice that achieves optimal generalization and safety performance. Our conjecture is that $\texttt{tanh}$ (similar to $\texttt{sin}$) allows continuity of value and its gradient, which is sufficient for the convergence of learning, and at the same time is expressive enough (similar to $\texttt{relu}$) at approximating discontinuous value landscapes. Lastly, we apply our method to approximating control policies for an incomplete-information interaction and demonstrate its contribution to safe interactions.  ( 3 min )

Although neural networks can solve very complex machine-learning problems, the theoretical reason for their generalizability is still not fully understood. Here we use Wang-Landau Mote Carlo algorithm to calculate the entropy (logarithm of the volume of a part of the parameter space) at a given test accuracy, and a given training loss function value or training accuracy. Our results show that entropical forces help generalizability. Although our study is on a very simple application of neural networks (a spiral dataset and a small, fully-connected neural network), our approach should be useful in explaining the generalizability of more complicated neural networks in future works.  ( 2 min )

We consider the problem of cost-optimal utilization of a crowdsourcing platform for binary, unsupervised classification of a collection of items, given a prescribed error threshold. Workers on the crowdsourcing platform are assumed to be divided into multiple classes, based on their skill, experience, and/or past performance. We model each worker class via an unknown confusion matrix, and a (known) price to be paid per label prediction. For this setting, we propose algorithms for acquiring label predictions from workers, and for inferring the true labels of items. We prove that if the number of (unlabeled) items available is large enough, our algorithms satisfy the prescribed error thresholds, incurring a cost that is near-optimal. Finally, we validate our algorithms, and some heuristics inspired by them, through an extensive case study.  ( 2 min )

Integer programming (IP) is an important and challenging problem. Approximate methods have shown promising performance on both effectiveness and efficiency for solving the IP problem. However, we observed that a large fraction of variables solved by some iterative approximate methods fluctuate around their final converged discrete states in very long iterations. Inspired by this observation, we aim to accelerate these approximate methods by early fixing these fluctuated variables to their converged states while not significantly harming the solution accuracy. To this end, we propose an early fixing framework along with the approximate method. We formulate the whole early fixing process as a Markov decision process, and train it using imitation learning. A policy network will evaluate the posterior probability of each free variable concerning its discrete candidate states in each block of iterations. Specifically, we adopt the powerful multi-headed attention mechanism in the policy network. Extensive experiments on our proposed early fixing framework are conducted to three different IP applications: constrained linear programming, MRF energy minimization and sparse adversarial attack. The former one is linear IP problem, while the latter two are quadratic IP problems. We extend the problem scale from regular size to significantly large size. The extensive experiments reveal the competitiveness of our early fixing framework: the runtime speeds up significantly, while the solution quality does not degrade much, even in some cases it is available to obtain better solutions. Our proposed early fixing framework can be regarded as an acceleration extension of ADMM methods for solving integer programming. The source codes are available at \url{https://github.com/SCLBD/Accelerated-Lpbox-ADMM}.  ( 3 min )

We present TabPFN, an AutoML method that is competitive with the state of the art on small tabular datasets while being over 1,000$\times$ faster. Our method is very simple: it is fully entailed in the weights of a single neural network, and a single forward pass directly yields predictions for a new dataset. Our AutoML method is meta-learned using the Transformer-based Prior-Data Fitted Network (PFN) architecture and approximates Bayesian inference with a prior that is based on assumptions of simplicity and causal structures. The prior contains a large space of structural causal models and Bayesian neural networks with a bias for small architectures and thus low complexity. Furthermore, we extend the PFN approach to differentiably calibrate the prior's hyperparameters on real data. By doing so, we separate our abstract prior assumptions from their heuristic calibration on real data. Afterwards, the calibrated hyperparameters are fixed and TabPFN can be applied to any new tabular dataset at the push of a button. Finally, on 30 datasets from the OpenML-CC18 suite we show that our method outperforms boosted trees and performs on par with complex state-of-the-art AutoML systems with predictions produced in less than a second. We provide all our code and our final trained TabPFN in the supplementary materials.  ( 2 min )

Long-term metric self-localization is an essential capability of autonomous mobile robots, but remains challenging for vision-based systems due to appearance changes caused by lighting, weather, or seasonal variations. While experience-based mapping has proven to be an effective technique for bridging the `appearance gap,' the number of experiences required for reliable metric localization over days or months can be very large, and methods for reducing the necessary number of experiences are needed for this approach to scale. Taking inspiration from color constancy theory, we learn a nonlinear RGB-to-grayscale mapping that explicitly maximizes the number of inlier feature matches for images captured under different lighting and weather conditions, and use it as a pre-processing step in a conventional single-experience localization pipeline to improve its robustness to appearance change. We train this mapping by approximating the target non-differentiable localization pipeline with a deep neural network, and find that incorporating a learned low-dimensional context feature can further improve cross-appearance feature matching. Using synthetic and real-world datasets, we demonstrate substantial improvements in localization performance across day-night cycles, enabling continuous metric localization over a 30-hour period using a single mapping experience, and allowing experience-based localization to scale to long deployments with dramatically reduced data requirements.  ( 3 min )

The author of this work proposes an overview of the recent semi-supervised learning approaches and related works. Despite the remarkable success of neural networks in various applications, there exist few formidable constraints including the need for a large amount of labeled data. Therefore, semi-supervised learning, which is a learning scheme in which the scarce labels and a larger amount of unlabeled data are utilized to train models (e.g., deep neural networks) is getting more important. Based on the key assumptions of semi-supervised learning, which are the manifold assumption, cluster assumption, and continuity assumption, the work reviews the recent semi-supervised learning approaches. In particular, the methods in regard to using deep neural networks in a semi-supervised learning setting are primarily discussed. In addition, the existing works are first classified based on the underlying idea and explained, and then the holistic approaches that unify the aforementioned ideas are detailed.  ( 2 min )

Reliable generalization lies at the heart of safe ML and AI. However, understanding when and how neural networks generalize remains one of the most important unsolved problems in the field. In this work, we conduct an extensive empirical study (2200 models, 16 tasks) to investigate whether insights from the theory of computation can predict the limits of neural network generalization in practice. We demonstrate that grouping tasks according to the Chomsky hierarchy allows us to forecast whether certain architectures will be able to generalize to out-of-distribution inputs. This includes negative results where even extensive amounts of data and training time never led to any non-trivial generalization, despite models having sufficient capacity to perfectly fit the training data. Our results show that, for our subset of tasks, RNNs and Transformers fail to generalize on non-regular tasks, LSTMs can solve regular and counter-language tasks, and only networks augmented with structured memory (such as a stack or memory tape) can successfully generalize on context-free and context-sensitive tasks.  ( 2 min )

This paper develops simple feed-forward neural networks that achieve the universal approximation property for all continuous functions with a fixed finite number of neurons. These neural networks are simple because they are designed with a simple and computable continuous activation function $\sigma$ leveraging a triangular-wave function and the softsign function. We prove that $\sigma$-activated networks with width $36d(2d+1)$ and depth $11$ can approximate any continuous function on a $d$-dimensional hypercube within an arbitrarily small error. Hence, for supervised learning and its related regression problems, the hypothesis space generated by these networks with a size not smaller than $36d(2d+1)\times 11$ is dense in the continuous function space $C([a,b]^d)$ and therefore dense in the Lebesgue spaces $L^p([a,b]^d)$ for $p\in [1,\infty)$. Furthermore, classification functions arising from image and signal classification are in the hypothesis space generated by $\sigma$-activated networks with width $36d(2d+1)$ and depth $12$, when there exist pairwise disjoint bounded closed subsets of $\mathbb{R}^d$ such that the samples of the same class are located in the same subset. Finally, we use numerical experimentation to show that replacing the ReLU activation function by ours would improve the experiment results.  ( 3 min )

Early diagnosis of disease can result in improved health outcomes, such as higher survival rates and lower treatment costs. With the massive amount of information in electronic health records (EHRs), there is great potential to use machine learning (ML) methods to model disease progression aimed at early prediction of disease onset and other outcomes. In this work, we employ recent innovations in neural ODEs to harness the full temporal information of EHRs. We propose ICE-NODE (Integration of Clinical Embeddings with Neural Ordinary Differential Equations), an architecture that temporally integrates embeddings of clinical codes and neural ODEs to learn and predict patient trajectories in EHRs. We apply our method to the publicly available MIMIC-III and MIMIC-IV datasets, reporting improved prediction results compared to state-of-the-art methods, specifically for clinical codes that are not frequently observed in EHRs. We also show that ICE-NODE is more competent at predicting certain medical conditions, like acute renal failure and pulmonary heart disease, and is also able to produce patient risk trajectories over time that can be exploited for further predictions.  ( 2 min )

Modern deep learning has achieved great success in various fields. However, it requires the labeling of huge amounts of data, which is expensive and labor-intensive. Active learning (AL), which identifies the most informative samples to be labeled, is becoming increasingly important to maximize the efficiency of the training process. The existing AL methods mostly use only a single final fixed model for acquiring the samples to be labeled. This strategy may not be good enough in that the structural uncertainty of a model for given training data is not considered to acquire the samples. In this study, we propose a novel acquisition criterion based on temporal self-ensemble generated by conventional stochastic gradient descent (SGD) optimization. These self-ensemble models are obtained by capturing the intermediate network weights obtained through SGD iterations. Our acquisition function relies on a consistency measure between the student and teacher models. The student models are given a fixed number of temporal self-ensemble models, and the teacher model is constructed by averaging the weights of the student models. Using the proposed acquisition criterion, we present an AL algorithm, namely student-teacher consistency-based AL (ST-CoNAL). Experiments conducted for image classification tasks on CIFAR-10, CIFAR-100, Caltech-256, and Tiny ImageNet datasets demonstrate that the proposed ST-CoNAL achieves significantly better performance than the existing acquisition methods. Furthermore, extensive experiments show the robustness and effectiveness of our methods.  ( 3 min )

Vision-and-Language Navigation (VLN) tasks require an agent to navigate through the environment based on language instructions. In this paper, we aim to solve two key challenges in this task: utilizing multilingual instructions for improved instruction-path grounding and navigating through new environments that are unseen during training. To address these challenges, we propose CLEAR: Cross-Lingual and Environment-Agnostic Representations. First, our agent learns a shared and visually-aligned cross-lingual language representation for the three languages (English, Hindi and Telugu) in the Room-Across-Room dataset. Our language representation learning is guided by text pairs that are aligned by visual information. Second, our agent learns an environment-agnostic visual representation by maximizing the similarity between semantically-aligned image pairs (with constraints on object-matching) from different environments. Our environment agnostic visual representation can mitigate the environment bias induced by low-level visual information. Empirically, on the Room-Across-Room dataset, we show that our multilingual agent gets large improvements in all metrics over the strong baseline model when generalizing to unseen environments with the cross-lingual language representation and the environment-agnostic visual representation. Furthermore, we show that our learned language and visual representations can be successfully transferred to the Room-to-Room and Cooperative Vision-and-Dialogue Navigation task, and present detailed qualitative and quantitative generalization and grounding analysis. Our code is available at https://github.com/jialuli-luka/CLEAR  ( 3 min )

With increasingly more sophisticated phishing campaigns in recent years, phishing emails lure people using more legitimate-looking personal contexts. To tackle this problem, instead of traditional heuristics-based algorithms, more adaptive detection systems such as natural language processing (NLP)-powered approaches are essential to understanding phishing text representations. Nevertheless, concerns surrounding the collection of phishing data that might cover confidential information hinder the effectiveness of model learning. We propose a decentralized phishing email detection framework called Federated Phish Bowl (FedPB) which facilitates collaborative phishing detection with privacy. In particular, we devise a knowledge-sharing mechanism with federated learning (FL). Using long short-term memory (LSTM) for phishing detection, the framework adapts by sharing a global word embedding matrix across the clients, with each client running its local model with Non-IID data. We collected the most recent phishing samples to study the effectiveness of the proposed method using different client numbers and data distributions. The results show that FedPB can attain a competitive performance with a centralized phishing detector, with generality to various cases of FL retaining a prediction accuracy of 83%.  ( 2 min )

In this paper, we conjecture that if the permutation invariance of neural networks is taken into account, SGD solutions will likely have no barrier in the linear interpolation between them. Although it is a bold conjecture, we show how extensive empirical attempts fall short of refuting it. We further provide a preliminary theoretical result to support our conjecture. Our conjecture has implications for lottery ticket hypothesis, distributed training, and ensemble methods.  ( 2 min )

Offline RL algorithms must account for the fact that the dataset they are provided may leave many facets of the environment unknown. The most common way to approach this challenge is to employ pessimistic or conservative methods, which avoid behaviors that are too dissimilar from those in the training dataset. However, relying exclusively on conservatism has drawbacks: performance is sensitive to the exact degree of conservatism, and conservative objectives can recover highly suboptimal policies. In this work, we propose that offline RL methods should instead be adaptive in the presence of uncertainty. We show that acting optimally in offline RL in a Bayesian sense involves solving an implicit POMDP. As a result, optimal policies for offline RL must be adaptive, depending not just on the current state but rather all the transitions seen so far during evaluation.We present a model-free algorithm for approximating this optimal adaptive policy, and demonstrate the efficacy of learning such adaptive policies in offline RL benchmarks.  ( 2 min )

The rapid growth of connected devices has led to the proliferation of novel cyber-security threats known as zero-day attacks. Traditional behaviour-based IDS rely on DNN to detect these attacks. The quality of the dataset used to train the DNN plays a critical role in the detection performance, with underrepresented samples causing poor performances. In this paper, we develop and evaluate the performance of DBN on detecting cyber-attacks within a network of connected devices. The CICIDS2017 dataset was used to train and evaluate the performance of our proposed DBN approach. Several class balancing techniques were applied and evaluated. Lastly, we compare our approach against a conventional MLP model and the existing state-of-the-art. Our proposed DBN approach shows competitive and promising results, with significant performance improvement on the detection of attacks underrepresented in the training dataset.  ( 2 min )

Self-supervised Contrastive Learning (CL) has been recently shown to be very effective in preventing deep networks from overfitting noisy labels. Despite its empirical success, the theoretical understanding of the effect of contrastive learning on boosting robustness is very limited. In this work, we rigorously prove that the representation matrix learned by contrastive learning boosts robustness, by having: (i) one prominent singular value corresponding to each sub-class in the data, and significantly smaller remaining singular values; and (ii) {a large alignment between the prominent singular vectors and the clean labels of each sub-class. The above properties enable a linear layer trained on such representations to effectively learn the clean labels without overfitting the noise.} We further show that the low-rank structure of the Jacobian of deep networks pre-trained with contrastive learning allows them to achieve a superior performance initially, when fine-tuned on noisy labels. Finally, we demonstrate that the initial robustness provided by contrastive learning enables robust training methods to achieve state-of-the-art performance under extreme noise levels, e.g., an average of 27.18\% and 15.58\% increase in accuracy on CIFAR-10 and CIFAR-100 with 80\% symmetric noisy labels, and 4.11\% increase in accuracy on WebVision.  ( 3 min )

Distribution inference, sometimes called property inference, infers statistical properties about a training set from access to a model trained on that data. Distribution inference attacks can pose serious risks when models are trained on private data, but are difficult to distinguish from the intrinsic purpose of statistical machine learning -- namely, to produce models that capture statistical properties about a distribution. Motivated by Yeom et al.'s membership inference framework, we propose a formal definition of distribution inference attacks that is general enough to describe a broad class of attacks distinguishing between possible training distributions. We show how our definition captures previous ratio-based property inference attacks as well as new kinds of attack including revealing the average node degree or clustering coefficient of a training graph. To understand distribution inference risks, we introduce a metric that quantifies observed leakage by relating it to the leakage that would occur if samples from the training distribution were provided directly to the adversary. We report on a series of experiments across a range of different distributions using both novel black-box attacks and improved versions of the state-of-the-art white-box attacks. Our results show that inexpensive attacks are often as effective as expensive meta-classifier attacks, and that there are surprising asymmetries in the effectiveness of attacks. Code is available at https://github.com/iamgroot42/FormEstDistRisks  ( 3 min )

Speech Neuroprostheses have the potential to enable communication for people with dysarthria or anarthria. Recent advances have demonstrated high-quality text decoding and speech synthesis from electrocorticographic grids placed on the cortical surface. Here, we investigate a less invasive measurement modality in three participants, namely stereotactic EEG (sEEG) that provides sparse sampling from multiple brain regions, including subcortical regions. To evaluate whether sEEG can also be used to synthesize high-quality audio from neural recordings, we employ a recurrent encoder-decoder model based on modern deep learning methods. We find that speech can indeed be reconstructed with correlations up to 0.8 from these minimally invasive recordings, despite limited amounts of training data.  ( 2 min )

There is a growing interest in the area of machine learning and creativity. This survey presents an overview of the history and the state of the art of computational creativity theories, key machine learning techniques (including generative deep learning), and corresponding automatic evaluation methods. After presenting a critical discussion of the key contributions in this area, we outline the current research challenges and emerging opportunities in this field.  ( 2 min )

Transferability estimation has been an essential tool in selecting a pre-trained model and the layers in it for transfer learning, to transfer, so as to maximize the performance on a target task and prevent negative transfer. Existing estimation algorithms either require intensive training on target tasks or have difficulties in evaluating the transferability between layers. To this end, we propose a simple, efficient, and effective transferability measure named TransRate. Through a single pass over examples of a target task, TransRate measures the transferability as the mutual information between features of target examples extracted by a pre-trained model and their labels. We overcome the challenge of efficient mutual information estimation by resorting to coding rate that serves as an effective alternative to entropy. From the perspective of feature representation, the resulting TransRate evaluates both completeness (whether features contain sufficient information of a target task) and compactness (whether features of each class are compact enough for good generalization) of pre-trained features. Theoretically, we have analyzed the close connection of TransRate to the performance after transfer learning. Despite its extraordinary simplicity in 10 lines of codes, TransRate performs remarkably well in extensive evaluations on 32 pre-trained models and 16 downstream tasks.  ( 3 min )

Stock portfolio optimization is the process of continuous reallocation of funds to a selection of stocks. This is a particularly well-suited problem for reinforcement learning, as daily rewards are compounding and objective functions may include more than just profit, e.g., risk and sustainability. We developed a novel utility function with the Sharpe ratio representing risk and the environmental, social, and governance score (ESG) representing sustainability. We show that a state-of-the-art policy gradient method - multi-agent deep deterministic policy gradients (MADDPG) - fails to find the optimum policy due to flat policy gradients and we therefore replaced gradient descent with a genetic algorithm for parameter optimization. We show that our system outperforms MADDPG while improving on deep Q-learning approaches by allowing for continuous action spaces. Crucially, by incorporating risk and sustainability criteria in the utility function, we improve on the state-of-the-art in reinforcement learning for portfolio optimization; risk and sustainability are essential in any modern trading strategy and we propose a system that does not merely report these metrics, but that actively optimizes the portfolio to improve on them.  ( 2 min )

We introduce Continual 3D Convolutional Neural Networks (Co3D CNNs), a new computational formulation of spatio-temporal 3D CNNs, in which videos are processed frame-by-frame rather than by clip. In online tasks demanding frame-wise predictions, Co3D CNNs dispense with the computational redundancies of regular 3D CNNs, namely the repeated convolutions over frames, which appear in overlapping clips. We show that Continual 3D CNNs can reuse preexisting 3D-CNN weights to reduce the per-prediction floating point operations (FLOPs) in proportion to the temporal receptive field while retaining similar memory requirements and accuracy. This is validated with multiple models on Kinetics-400 and Charades with remarkable results: CoX3D models attain state-of-the-art complexity/accuracy trade-offs on Kinetics-400 with 12.1-15.3x reductions of FLOPs and 2.3-3.8% improvements in accuracy compared to regular X3D models while reducing peak memory consumption by up to 48%. Moreover, we investigate the transient response of Co3D CNNs at start-up and perform extensive benchmarks of on-hardware processing characteristics for publicly available 3D CNNs.  ( 2 min )

We propose a hybrid framework opPINN: physics-informed neural network (PINN) with operator learning for approximating the solution to the Fokker-Planck-Landau (FPL) equation. The opPINN framework is divided into two steps: Step 1 and Step 2. After the operator surrogate models are trained during Step 1, PINN can effectively approximate the solution to the FPL equation during Step 2 by using the pre-trained surrogate models. The operator surrogate models greatly reduce the computational cost and boost PINN by approximating the complex Landau collision integral in the FPL equation. The operator surrogate models can also be combined with the traditional numerical schemes. It provides a high efficiency in computational time when the number of velocity modes becomes larger. Using the opPINN framework, we provide the neural network solutions for the FPL equation under the various types of initial conditions, and interaction models in two and three dimensions. Furthermore, based on the theoretical properties of the FPL equation, we show that the approximated neural network solution converges to the a priori classical solution of the FPL equation as the pre-defined loss function is reduced.  ( 2 min )

Self-attention mechanisms model long-range context by using pairwise attention between all input tokens. In doing so, they assume a fixed attention granularity defined by the individual tokens (e.g., text characters or image pixels), which may not be optimal for modeling complex dependencies at higher levels. In this paper, we propose ContextPool to address this problem by adapting the attention granularity for each token. Inspired by the success of ConvNets that are combined with pooling to capture long-range dependencies, we learn to pool neighboring features for each token before computing attention in a given attention layer. The pooling weights and support size are adaptively determined, allowing the pooled features to encode meaningful context with varying scale. We show that ContextPool makes attention models more expressive, achieving strong performance often with fewer layers and thus significantly reduced cost. Experiments validate that our ContextPool module, when plugged into transformer models, matches or surpasses state-of-the-art performance using less compute on several language and image benchmarks, outperforms recent works with learned context sizes or sparse attention patterns, and is also applicable to ConvNets for efficient feature learning.  ( 2 min )

Transfer learning refers to the transfer of knowledge or information from a relevant source task to a target task. However, most existing works assume both tasks are sampled from a stationary task distribution, thereby leading to the sub-optimal performance for dynamic tasks drawn from a non-stationary task distribution in real scenarios. To bridge this gap, in this paper, we study a more realistic and challenging transfer learning setting with dynamic tasks, i.e., source and target tasks are continuously evolving over time. We theoretically show that the expected error on the dynamic target task can be tightly bounded in terms of source knowledge and consecutive distribution discrepancy across tasks. This result motivates us to propose a generic meta-learning framework L2E for modeling the knowledge transferability on dynamic tasks. It is centered around a task-guided meta-learning problem with a group of meta-pairs of tasks, based on which we are able to learn the prior model initialization for fast adaptation on the newest target task. L2E enjoys the following properties: (1) effective knowledge transferability across dynamic tasks; (2) fast adaptation to the new target task; (3) mitigation of catastrophic forgetting on historical target tasks; and (4) flexibility in incorporating any existing static transfer learning algorithms. Extensive experiments on various image data sets demonstrate the effectiveness of the proposed L2E framework.  ( 2 min )

The reliability of segmentation models in the medical domain depends on the model's robustness to perturbations in the input space. Robustness is a particular challenge in medical imaging exhibiting various sources of image noise, corruptions, and domain shifts. Obtaining robustness is often attempted via simulating heterogeneous environments, either heuristically in the form of data augmentation or by learning to generate specific perturbations in an adversarial manner. We propose and justify that learning a discrete representation in a low dimensional embedding space improves robustness of a segmentation model. This is achieved with a dictionary learning method called vector quantisation. We use a set of experiments designed to analyse robustness in both the latent and output space under domain shift and noise perturbations in the input space. We adapt the popular UNet architecture, inserting a quantisation block in the bottleneck. We demonstrate improved segmentation accuracy and better robustness on three segmentation tasks. Code is available at \url{https://github.com/AinkaranSanthi/Vector-Quantisation-for-Robust-Segmentation}  ( 2 min )

Many works have recently explored Sim-to-real transferable visual model predictive control (MPC). However, such works are limited to one-shot transfer, where real-world data must be collected once to perform the sim-to-real transfer, which remains a significant human effort in transferring the models learned in simulations to new domains in the real world. To alleviate this problem, we first propose a novel model-learning framework called Kalman Randomized-to-Canonical Model (KRC-model). This framework is capable of extracting task-relevant intrinsic features and their dynamics from randomized images. We then propose Kalman Randomized-to-Canonical Model Predictive Control (KRC-MPC) as a zero-shot sim-to-real transferable visual MPC using KRC-model. The effectiveness of our method is evaluated through a valve rotation task by a robot hand in both simulation and the real world, and a block mating task in simulation. The experimental results show that KRC-MPC can be applied to various real domains and tasks in a zero-shot manner.  ( 2 min )

An increasing body of work has recognized the importance of exploiting machine learning (ML) advancements to address the need for efficient automation in extracting access control attributes, policy mining, policy verification, access decisions, etc. In this work, we survey and summarize various ML approaches to solve different access control problems. We propose a novel taxonomy of the ML model's application in the access control domain. We highlight current limitations and open challenges such as lack of public real-world datasets, administration of ML-based access control systems, understanding a black-box ML model's decision, etc., and enumerate future research directions.  ( 2 min )

Deep learning-based classification of rare anemia disorders is challenged by the lack of training data and instance-level annotations. Multiple Instance Learning (MIL) has shown to be an effective solution, yet it suffers from low accuracy and limited explainability. Although the inclusion of attention mechanisms has addressed these issues, their effectiveness highly depends on the amount and diversity of cells in the training samples. Consequently, the poor machine learning performance on rare anemia disorder classification from blood samples remains unresolved. In this paper, we propose an interpretable pooling method for MIL to address these limitations. By benefiting from instance-level information of negative bags (i.e., homogeneous benign cells from healthy individuals), our approach increases the contribution of anomalous instances. We show that our strategy outperforms standard MIL classification algorithms and provides a meaningful explanation behind its decisions. Moreover, it can denote anomalous instances of rare blood diseases that are not seen during the training phase.  ( 2 min )

In a preference learning setting, every participant chooses an ordered list of $k$ most preferred items among a displayed set of candidates. (The set can be different for every participant.) We identify a distance-based ranking model for the population's preferences and their (ranked) choice behavior. The ranking model resembles the Mallows model but uses a new distance function called Reverse Major Index (RMJ). We find that despite the need to sum over all permutations, the RMJ-based ranking distribution aggregates into (ranked) choice probabilities with simple closed-form expression. We develop effective methods to estimate the model parameters and showcase their generalization power using real data, especially when there is a limited variety of display sets.  ( 2 min )

Healthcare datasets present many challenges to both machine learning and statistics as their data are typically heterogeneous, censored, high-dimensional and have missing information. Feature selection is often used to identify the important features but can produce unstable results when applied to high-dimensional data, selecting a different set of features on each iteration. The stability of feature selection can be improved with the use of feature selection ensembles, which aggregate the results of multiple base feature selectors. A threshold must be applied to the final aggregated feature set to separate the relevant features from the redundant ones. A fixed threshold, which is typically applied, offers no guarantee that the final set of selected features contains only relevant features. This work develops several data-driven thresholds to automatically identify the relevant features in an ensemble feature selector and evaluates their predictive accuracy and stability. To demonstrate the applicability of these methods to clinical data, they are applied to data from two real-world Alzheimer's disease (AD) studies. AD is a progressive neurodegenerative disease with no known cure, that begins at least 2-3 decades before overt symptoms appear, presenting an opportunity for researchers to identify early biomarkers that might identify patients at risk of developing AD. Features identified by applying these methods to both datasets reflect current findings in the AD literature.  ( 3 min )

While normalizing flows for continuous data have been extensively researched, flows for discrete data have only recently been explored. These prior models, however, suffer from limitations that are distinct from those of continuous flows. Most notably, discrete flow-based models cannot be straightforwardly optimized with conventional deep learning methods because gradients of discrete functions are undefined or zero. Previous works approximate pseudo-gradients of the discrete functions but do not solve the problem on a fundamental level. In addition to that, backpropagation can be computationally burdensome compared to alternative discrete algorithms such as decision tree algorithms. Our approach seeks to reduce computational burden and remove the need for pseudo-gradients by developing a discrete flow based on decision trees -- building upon the success of efficient tree-based methods for classification and regression for discrete data. We first define a tree-structured permutation (TSP) that compactly encodes a permutation of discrete data where the inverse is easy to compute; thus, we can efficiently compute the density value and sample new data. We then propose a decision tree algorithm to build TSPs that learns the tree structure and permutations at each node via novel criteria. We empirically demonstrate the feasibility of our method on multiple datasets.  ( 2 min )

Generalized Zero-Shot Learning (GZSL) aims to recognize images from both the seen and unseen classes by transferring semantic knowledge from seen to unseen classes. It is a promising solution to take the advantage of generative models to hallucinate realistic unseen samples based on the knowledge learned from the seen classes. However, due to the generation shifts, the synthesized samples by most existing methods may drift from the real distribution of the unseen data. To address this issue, we propose a novel flow-based generative framework that consists of multiple conditional affine coupling layers for learning unseen data generation. Specifically, we discover and address three potential problems that trigger the generation shifts, i.e., semantic inconsistency, variance collapse, and structure disorder. First, to enhance the reflection of the semantic information in the generated samples, we explicitly embed the semantic information into the transformation in each conditional affine coupling layer. Second, to recover the intrinsic variance of the real unseen features, we introduce a boundary sample mining strategy with entropy maximization to discover more difficult visual variants of semantic prototypes and hereby adjust the decision boundary of the classifiers. Third, a relative positioning strategy is proposed to revise the attribute embeddings, guiding them to fully preserve the inter-class geometric structure and further avoid structure disorder in the semantic space. Extensive experimental results on four GZSL benchmark datasets demonstrate that GSMFlow achieves the state-of-the-art performance on GZSL.  ( 3 min )

Given a small training data set and a learning algorithm, how much more data is necessary to reach a target validation or test performance? This question is of critical importance in applications such as autonomous driving or medical imaging where collecting data is expensive and time-consuming. Overestimating or underestimating data requirements incurs substantial costs that could be avoided with an adequate budget. Prior work on neural scaling laws suggest that the power-law function can fit the validation performance curve and extrapolate it to larger data set sizes. We find that this does not immediately translate to the more difficult downstream task of estimating the required data set size to meet a target performance. In this work, we consider a broad class of computer vision tasks and systematically investigate a family of functions that generalize the power-law function to allow for better estimation of data requirements. Finally, we show that incorporating a tuned correction factor and collecting over multiple rounds significantly improves the performance of the data estimators. Using our guidelines, practitioners can accurately estimate data requirements of machine learning systems to gain savings in both development time and data acquisition costs.  ( 3 min )

Program synthesis or code generation aims to generate a program that satisfies a problem specification. Recent approaches using large-scale pretrained language models (LMs) have shown promising results, yet they have some critical limitations. In particular, they often follow a standard supervised fine-tuning procedure to train a code generation model only from the pairs of natural-language problem descriptions and ground-truth programs. Such paradigm largely ignores some important but potentially useful signals in the problem specification such as unit tests, which thus often results in poor performance when solving complex unseen coding tasks. To address the limitations, we propose "CodeRL", a new framework for program synthesis tasks through pretrained LMs and deep reinforcement learning (RL). Specifically, during training, we treat the code-generating LM as an actor network, and introduce a critic network that is trained to predict the functional correctness of generated programs and provide dense feedback signals to the actor. During inference, we introduce a new generation procedure with a critical sampling strategy that allows a model to automatically regenerate programs based on feedback from example unit tests and critic scores. For the model backbones, we extended the encoder-decoder architecture of CodeT5 with enhanced learning objectives, larger model sizes, and better pretraining data. Our method not only achieves new SOTA results on the challenging APPS benchmark, but also shows strong zero-shot transfer capability with new SOTA results on the simpler MBPP benchmark.  ( 3 min )

It has been intensively investigated that the local shape, especially flatness, of the loss landscape near a minimum plays an important role for generalization of deep models. We developed a training algorithm called PoF: Post-Training of Feature Extractor that updates the feature extractor part of an already-trained deep model to search a flatter minimum. The characteristics are two-fold: 1) Feature extractor is trained under parameter perturbations in the higher-layer parameter space, based on observations that suggest flattening higher-layer parameter space, and 2) the perturbation range is determined in a data-driven manner aiming to reduce a part of test loss caused by the positive loss curvature. We provide a theoretical analysis that shows the proposed algorithm implicitly reduces the target Hessian components as well as the loss. Experimental results show that PoF improved model performance against baseline methods on both CIFAR-10 and CIFAR-100 datasets for only 10-epoch post-training, and on SVHN dataset for 50-epoch post-training. Source code is available at: \url{https://github.com/DensoITLab/PoF-v1  ( 2 min )

Reinforcement learning (RL) is recognized as lacking generalization and robustness under environmental perturbations, which excessively restricts its application for real-world robotics. Prior work claimed that adding regularization to the value function is equivalent to learning a robust policy with uncertain transitions. Although the regularization-robustness transformation is appealing for its simplicity and efficiency, it is still lacking in continuous control tasks. In this paper, we propose a new regularizer named $\textbf{U}$ncertainty $\textbf{S}$et $\textbf{R}$egularizer (USR), by formulating the uncertainty set on the parameter space of the transition function. In particular, USR is flexible enough to be plugged into any existing RL framework. To deal with unknown uncertainty sets, we further propose a novel adversarial approach to generate them based on the value function. We evaluate USR on the Real-world Reinforcement Learning (RWRL) benchmark, demonstrating improvements in the robust performance for perturbed testing environments.  ( 2 min )

In the past two decades, several Machine Learning (ML) libraries have become freely available. Many studies have used such libraries to carry out empirical investigations on predictive Software Engineering (SE) tasks. However, the differences stemming from using one library over another have been overlooked, implicitly assuming that using any of these libraries would provide the user with the same or very similar results. This paper aims at raising awareness of the differences incurred when using different ML libraries for software development effort estimation (SEE), one of most widely studied SE prediction tasks. To this end, we investigate 4 deterministic machine learners as provided by 3 of the most popular ML open-source libraries written in different languages (namely, Scikit-Learn, Caret and Weka). We carry out a thorough empirical study comparing the performance of the machine learners on 5 SEE datasets in the two most common SEE scenarios (i.e., out-of-the-box-ml and tuned-ml) as well as an in-depth analysis of the documentation and code of their APIs. The results of our study reveal that the predictions provided by the 3 libraries differ in 95% of the cases on average across a total of 105 cases studied. These differences are significantly large in most cases and yield misestimations of up to approx. 3,000 hours per project. Moreover, our API analysis reveals that these libraries provide the user with different levels of control on the parameters one can manipulate, and a lack of clarity and consistency, overall, which might mislead users. Our findings highlight that the ML library is an important design choice for SEE studies, which can lead to a difference in performance. However, such a difference is under-documented. We conclude by highlighting open-challenges with suggestions for the developers of libraries as well as for the researchers and practitioners using them.  ( 3 min )

We establish error estimates for the approximation of parametric $p$-Dirichlet problems deploying the Deep Ritz Method. Parametric dependencies include, e.g., varying geometries and exponents $p\in (1,\infty)$. Combining the derived error estimates with quantitative approximation theorems yields error decay rates and establishes that the Deep Ritz Method retains the favorable approximation capabilities of neural networks in the approximation of high dimensional functions which makes the method attractive for parametric problems. Finally, we present numerical examples to illustrate potential applications.  ( 2 min )

Graph neural networks (GNNs) have gained traction over the past few years for their superior performance in numerous machine learning tasks. Graph Convolutional Neural Networks (GCN) are a common variant of GNNs that are known to have high performance in semi-supervised node classification (SSNC), and work well under the assumption of homophily. Recent literature has highlighted that GCNs can achieve strong performance on heterophilous graphs under certain "special conditions". These arguments motivate us to understand why, and how, GCNs learn to perform SSNC. We find a positive correlation between similarity of latent node embeddings of nodes within a class and the performance of a GCN. Our investigation on underlying graph structures of a dataset finds that a GCN's SSNC performance is significantly influenced by the consistency and uniqueness in neighborhood structure of nodes within a class.  ( 2 min )

Random forests is one of the most widely used machine learning methods over the past decade thanks to its outstanding empirical performance. Yet, because of its black-box nature, the results by random forests can be hard to interpret in many big data applications. Quantifying the usefulness of individual features in random forests learning can greatly enhance its interpretability. Existing studies have shown that some popularly used feature importance measures for random forests suffer from the bias issue. In addition, there lack comprehensive size and power analyses for most of these existing methods. In this paper, we approach the problem via hypothesis testing, and suggest a framework of the self-normalized feature-residual correlation test (FACT) for evaluating the significance of a given feature in the random forests model with bias-resistance property, where our null hypothesis concerns whether the feature is conditionally independent of the response given all other features. Such an endeavor on random forests inference is empowered by some recent developments on high-dimensional random forests consistency. The vanilla version of our FACT test can suffer from the bias issue in the presence of feature dependency. We exploit the techniques of imbalancing and conditioning for bias correction. We further incorporate the ensemble idea into the FACT statistic through feature transformations for the enhanced power. Under a fairly general high-dimensional nonparametric model setting with dependent features, we formally establish that FACT can provide theoretically justified random forests feature p-values and enjoy appealing power through nonasymptotic analyses. The theoretical results and finite-sample advantages of the newly suggested method are illustrated with several simulation examples and an economic forecasting application in relation to COVID-19.  ( 3 min )

Tumor segmentation is a fundamental step for radiotherapy treatment planning. To define an accurate segmentation of the primary tumor (GTVp) of oropharyngeal cancer patients (OPC), simultaneous assessment of different image modalities is needed, and each image volume is explored slice-by-slice from different orientations. Moreover, the manual fixed boundary of segmentation neglects the spatial uncertainty known to occur in tumor delineation. This study proposes a novel automatic deep learning (DL) model to assist radiation oncologists in a slice-by-slice adaptive GTVp segmentation on registered FDG PET/CT images. We included 138 OPC patients treated with (chemo)radiation in our institute. Our DL framework exploits both inter and intra-slice context. Sequences of 3 consecutive 2D slices of concatenated FDG PET/CT images and GTVp contours were used as input. A 3-fold cross validation was performed three times, training on sequences extracted from the Axial (A), Sagittal (S), and Coronal (C) plane of 113 patients. Since consecutive sequences in a volume contain overlapping slices, each slice resulted in three outcome predictions that were averaged. In the A, S, and C planes, the output shows areas with different probabilities of predicting the tumor. The performance of the models was assessed on 25 patients at different probability thresholds using the mean Dice Score Coefficient (DSC). Predictions were the closest to the ground truth at a probability threshold of 0.9 (DSC of 0.70 in the A, 0.77 in the S, and 0.80 in the C plane). The promising results of the proposed DL model show that the probability maps on registered FDG PET/CT images could guide radiation oncologists in a slice-by-slice adaptive GTVp segmentation.  ( 3 min )

Offline RL algorithms must account for the fact that the dataset they are provided may leave many facets of the environment unknown. The most common way to approach this challenge is to employ pessimistic or conservative methods, which avoid behaviors that are too dissimilar from those in the training dataset. However, relying exclusively on conservatism has drawbacks: performance is sensitive to the exact degree of conservatism, and conservative objectives can recover highly suboptimal policies. In this work, we propose that offline RL methods should instead be adaptive in the presence of uncertainty. We show that acting optimally in offline RL in a Bayesian sense involves solving an implicit POMDP. As a result, optimal policies for offline RL must be adaptive, depending not just on the current state but rather all the transitions seen so far during evaluation.We present a model-free algorithm for approximating this optimal adaptive policy, and demonstrate the efficacy of learning such adaptive policies in offline RL benchmarks.  ( 2 min )

A distinguishing characteristic of federated learning is that the (local) client data could have statistical heterogeneity. This heterogeneity has motivated the design of personalized learning, where individual (personalized) models are trained, through collaboration. There have been various personalization methods proposed in literature, with seemingly very different forms and methods ranging from use of a single global model for local regularization and model interpolation, to use of multiple global models for personalized clustering, etc. In this work, we begin with a generative framework that could potentially unify several different algorithms as well as suggest new algorithms. We apply our generative framework to personalized estimation, and connect it to the classical empirical Bayes' methodology. We develop private personalized estimation under this framework. We then use our generative framework for learning, which unifies several known personalized FL algorithms and also suggests new ones; we propose and study a new algorithm AdaPeD based on a Knowledge Distillation, which numerically outperforms several known algorithms. We also develop privacy for personalized learning methods with guarantees for user-level privacy and composition. We numerically evaluate the performance as well as the privacy for both the estimation and learning problems, demonstrating the advantages of our proposed methods.

Model-based reinforcement learning has attracted wide attention due to its superior sample efficiency. Despite its impressive success so far, it is still unclear how to appropriately schedule the important hyperparameters to achieve adequate performance, such as the real data ratio for policy optimization in Dyna-style model-based algorithms. In this paper, we first theoretically analyze the role of real data in policy training, which suggests that gradually increasing the ratio of real data yields better performance. Inspired by the analysis, we propose a framework named AutoMBPO to automatically schedule the real data ratio as well as other hyperparameters in training model-based policy optimization (MBPO) algorithm, a representative running case of model-based methods. On several continuous control tasks, the MBPO instance trained with hyperparameters scheduled by AutoMBPO can significantly surpass the original one, and the real data ratio schedule found by AutoMBPO shows consistency with our theoretical analysis.

In this work we propose a deep adaptive sampling (DAS) method for solving partial differential equations (PDEs), where deep neural networks are utilized to approximate the solutions of PDEs and deep generative models are employed to generate new collocation points that refine the training set. The overall procedure of DAS consists of two components: solving the PDEs by minimizing the residual loss on the collocation points in the training set and generating a new training set to further improve the accuracy of current approximate solution. In particular, we treat the residual as a probability density function and approximate it with a deep generative model, called KRnet. The new samples from KRnet are consistent with the distribution induced by the residual, i.e., more samples are located in the region of large residual and less samples are located in the region of small residual. Analogous to classical adaptive methods such as the adaptive finite element, KRnet acts as an error indicator that guides the refinement of the training set. Compared to the neural network approximation obtained with uniformly distributed collocation points, the developed algorithms can significantly improve the accuracy, especially for low regularity and high-dimensional problems. We demonstrate the effectiveness of the proposed DAS method with numerical experiments.

We study the stochastic shortest path (SSP) problem in reinforcement learning with linear function approximation, where the transition kernel is represented as a linear mixture of unknown models. We call this class of SSP problems as linear mixture SSPs. We propose a novel algorithm with Hoeffding-type confidence sets for learning the linear mixture SSP, which can attain an $\tilde{\mathcal{O}}(d B_{\star}^{1.5}\sqrt{K/c_{\min}})$ regret. Here $K$ is the number of episodes, $d$ is the dimension of the feature mapping in the mixture model, $B_{\star}$ bounds the expected cumulative cost of the optimal policy, and $c_{\min}>0$ is the lower bound of the cost function. Our algorithm also applies to the case when $c_{\min} = 0$, and an $\tilde{\mathcal{O}}(K^{2/3})$ regret is guaranteed. To the best of our knowledge, this is the first algorithm with a sublinear regret guarantee for learning linear mixture SSP. Moreover, we design a refined Bernstein-type confidence set and propose an improved algorithm, which provably achieves an $\tilde{\mathcal{O}}(d B_{\star}\sqrt{K/c_{\min}})$ regret. In complement to the regret upper bounds, we also prove a lower bound of $\Omega(dB_{\star} \sqrt{K})$. Hence, our improved algorithm matches the lower bound up to a $1/\sqrt{c_{\min}}$ factor and poly-logarithmic factors, achieving a near-optimal regret guarantee.

Random Forests (RF) is a popular machine learning method for classification and regression problems. It involves a bagging application to decision tree models. One of the primary advantages of the Random Forests model is the reduction in the variance of the forecast. In large scale applications of the model with millions of data points and hundreds of features, the size of the fitted objects can get very large and reach the limits on the available space in production setups, depending on the number and depth of the trees. This could be especially challenging when trained models need to be downloaded on-demand to small devices with limited memory. There is a need to approximate the trained RF models to significantly reduce the model size without losing too much of prediction accuracy. In this project we study methods that approximate each fitted tree in the Random Forests model using the multinomial allocation of the data points to the leafs. Specifically, we begin by studying whether fitting a multinomial logistic regression (and subsequently, a generalized additive model (GAM) extension) to the output of each tree helps reduce the size while preserving the prediction quality.  ( 2 min )

In safety-critical deep learning applications robustness measurement is a vital pre-deployment phase. However, existing robustness verification methods are not sufficiently practical for deploying machine learning systems in the real world. On the one hand, these methods attempt to claim that no perturbations can ``fool'' deep neural networks (DNNs), which may be too stringent in practice. On the other hand, existing works rigorously consider $L_p$ bounded additive perturbations on the pixel space, although perturbations, such as colour shifting and geometric transformations, are more practically and frequently occurring in the real world. Thus, from the practical standpoint, we present a novel and general {\it probabilistic robustness assessment method} (PRoA) based on the adaptive concentration, and it can measure the robustness of deep learning models against functional perturbations. PRoA can provide statistical guarantees on the probabilistic robustness of a model, \textit{i.e.}, the probability of failure encountered by the trained model after deployment. Our experiments demonstrate the effectiveness and flexibility of PRoA in terms of evaluating the probabilistic robustness against a broad range of functional perturbations, and PRoA can scale well to various large-scale deep neural networks compared to existing state-of-the-art baselines. For the purpose of reproducibility, we release our tool on GitHub: \url{ https://github.com/TrustAI/PRoA}.

Graph Neural Networks (GNNs) have achieved state-of-the-art results on many graph analysis tasks such as node classification and link prediction. However, important unsupervised problems on graphs, such as graph clustering, have proved more resistant to advances in GNNs. Graph clustering has the same overall goal as node pooling in GNNs - does this mean that GNN pooling methods do a good job at clusterings graphs? Surprisingly, the answer is no - current GNN pooling methods often fail to recover the cluster structure in cases where simple baselines, such as k-means applied on learned representations, work well. We investigate further by carefully designing a set of experiments to study different signal-to-noise scenarios both in graph structure and attribute data. To address these methods' poor performance in clustering, we introduce Deep Modularity Networks (DMoN), an unsupervised pooling method inspired by the modularity measure of clustering quality, and show how it tackles recovery of the challenging clustering structure of real-world graphs. Similarly, on real-world data, we show that DMoN produces high quality clusters which correlate strongly with ground truth labels, achieving state-of-the-art results with over 40% improvement over other pooling methods across different metrics.

Few Bayesian methods for analyzing high-dimensional sparse survival data provide scalable variable selection, effect estimation and uncertainty quantification. Such methods often either sacrifice uncertainty quantification by computing maximum a posteriori estimates, or quantify the uncertainty at high (unscalable) computational expense. We bridge this gap and develop an interpretable and scalable Bayesian proportional hazards model for prediction and variable selection, referred to as SVB. Our method, based on a mean-field variational approximation, overcomes the high computational cost of MCMC whilst retaining useful features, providing a posterior distribution for the parameters and offering a natural mechanism for variable selection via posterior inclusion probabilities. The performance of our proposed method is assessed via extensive simulations and compared against other state-of-the-art Bayesian variable selection methods, demonstrating comparable or better performance. Finally, we demonstrate how the proposed method can be used for variable selection on two transcriptomic datasets with censored survival outcomes, and how the uncertainty quantification offered by our method can be used to provide an interpretable assessment of patient risk.

We propose an algorithm for non-stationary kernel bandits that does not require prior knowledge of the degree of non-stationarity. The algorithm follows randomized strategies obtained by solving optimization problems that balance exploration and exploitation. It adapts to non-stationarity by restarting when a change in the reward function is detected. Our algorithm enjoys a tighter dynamic regret bound than previous work on the non-stationary kernel bandit setting. Moreover, when applied to the non-stationary linear bandit setting by using a linear kernel, our algorithm is nearly minimax optimal, solving an open problem in the non-stationary linear bandit literature. We extend our algorithm to use a neural network for dynamically adapting the feature mapping to observed data. We prove a dynamic regret bound of the extension using the neural tangent kernel theory. We demonstrate empirically that our algorithm and the extension can adapt to varying degrees of non-stationarity.

Multimodal learning is a framework for building models that make predictions based on different types of modalities. Important challenges in multimodal learning are the inference of shared representations from arbitrary modalities and cross-modal generation via these representations; however, achieving this requires taking the heterogeneous nature of multimodal data into account. In recent years, deep generative models, i.e., generative models in which distributions are parameterized by deep neural networks, have attracted much attention, especially variational autoencoders, which are suitable for accomplishing the above challenges because they can consider heterogeneity and infer good representations of data. Therefore, various multimodal generative models based on variational autoencoders, called multimodal deep generative models, have been proposed in recent years. In this paper, we provide a categorized survey of studies on multimodal deep generative models.

Stochastic processes provide a mathematically elegant way model complex data. In theory, they provide flexible priors over function classes that can encode a wide range of interesting assumptions. In practice, however, efficient inference by optimisation or marginalisation is difficult, a problem further exacerbated with big data and high dimensional input spaces. We propose a novel variational autoencoder (VAE) called the prior encoding variational autoencoder ($\pi$VAE). The $\pi$VAE is finitely exchangeable and Kolmogorov consistent, and thus is a continuous stochastic process. We use $\pi$VAE to learn low dimensional embeddings of function classes. We show that our framework can accurately learn expressive function classes such as Gaussian processes, but also properties of functions to enable statistical inference (such as the integral of a log Gaussian process). For popular tasks, such as spatial interpolation, $\pi$VAE achieves state-of-the-art performance both in terms of accuracy and computational efficiency. Perhaps most usefully, we demonstrate that the low dimensional independently distributed latent space representation learnt provides an elegant and scalable means of performing Bayesian inference for stochastic processes within probabilistic programming languages such as Stan.

Personalized medicine, a paradigm of medicine tailored to a patient's characteristics, is an increasingly attractive field in health care. An important goal of personalized medicine is to identify a subgroup of patients, based on baseline covariates, that benefits more from the targeted treatment than other comparative treatments. Most of the current subgroup identification methods only focus on obtaining a subgroup with an enhanced treatment effect without paying attention to subgroup size. Yet, a clinically meaningful subgroup learning approach should identify the maximum number of patients who can benefit from the better treatment. In this paper, we present an optimal subgroup selection rule (SSR) that maximizes the number of selected patients, and in the meantime, achieves the pre-specified clinically meaningful mean outcome, such as the average treatment effect. We derive two equivalent theoretical forms of the optimal SSR based on the contrast function that describes the treatment-covariates interaction in the outcome. We further propose a ConstrAined PolIcy Tree seArch aLgorithm (CAPITAL) to find the optimal SSR within the interpretable decision tree class. The proposed method is flexible to handle multiple constraints that penalize the inclusion of patients with negative treatment effects, and to address time to event data using the restricted mean survival time as the clinically interesting mean outcome. Extensive simulations, comparison studies, and real data applications are conducted to demonstrate the validity and utility of our method.

Optimal transport (OT) provides effective tools for comparing and mapping probability measures. We propose to leverage the flexibility of neural networks to learn an approximate optimal transport map. More precisely, we present a new and original method to address the problem of transporting a finite set of samples associated with a first underlying unknown distribution towards another finite set of samples drawn from another unknown distribution. We show that a particular instance of invertible neural networks, namely the normalizing flows, can be used to approximate the solution of this OT problem between a pair of empirical distributions. To this aim, we propose to relax the Monge formulation of OT by replacing the equality constraint on the push-forward measure by the minimization of the corresponding Wasserstein distance. The push-forward operator to be retrieved is then restricted to be a normalizing flow which is trained by optimizing the resulting cost function. This approach allows the transport map to be discretized as a composition of functions. Each of these functions is associated to one sub-flow of the network, whose output provides intermediate steps of the transport between the original and target measures. This discretization yields also a set of intermediate barycenters between the two measures of interest. Experiments conducted on toy examples as well as a challenging task of unsupervised translation demonstrate the interest of the proposed method. Finally, some experiments show that the proposed approach leads to a good approximation of the true OT.

Random forests is one of the most widely used machine learning methods over the past decade thanks to its outstanding empirical performance. Yet, because of its black-box nature, the results by random forests can be hard to interpret in many big data applications. Quantifying the usefulness of individual features in random forests learning can greatly enhance its interpretability. Existing studies have shown that some popularly used feature importance measures for random forests suffer from the bias issue. In addition, there lack comprehensive size and power analyses for most of these existing methods. In this paper, we approach the problem via hypothesis testing, and suggest a framework of the self-normalized feature-residual correlation test (FACT) for evaluating the significance of a given feature in the random forests model with bias-resistance property, where our null hypothesis concerns whether the feature is conditionally independent of the response given all other features. Such an endeavor on random forests inference is empowered by some recent developments on high-dimensional random forests consistency. The vanilla version of our FACT test can suffer from the bias issue in the presence of feature dependency. We exploit the techniques of imbalancing and conditioning for bias correction. We further incorporate the ensemble idea into the FACT statistic through feature transformations for the enhanced power. Under a fairly general high-dimensional nonparametric model setting with dependent features, we formally establish that FACT can provide theoretically justified random forests feature p-values and enjoy appealing power through nonasymptotic analyses. The theoretical results and finite-sample advantages of the newly suggested method are illustrated with several simulation examples and an economic forecasting application in relation to COVID-19.

We present TabPFN, an AutoML method that is competitive with the state of the art on small tabular datasets while being over 1,000$\times$ faster. Our method is very simple: it is fully entailed in the weights of a single neural network, and a single forward pass directly yields predictions for a new dataset. Our AutoML method is meta-learned using the Transformer-based Prior-Data Fitted Network (PFN) architecture and approximates Bayesian inference with a prior that is based on assumptions of simplicity and causal structures. The prior contains a large space of structural causal models and Bayesian neural networks with a bias for small architectures and thus low complexity. Furthermore, we extend the PFN approach to differentiably calibrate the prior's hyperparameters on real data. By doing so, we separate our abstract prior assumptions from their heuristic calibration on real data. Afterwards, the calibrated hyperparameters are fixed and TabPFN can be applied to any new tabular dataset at the push of a button. Finally, on 30 datasets from the OpenML-CC18 suite we show that our method outperforms boosted trees and performs on par with complex state-of-the-art AutoML systems with predictions produced in less than a second. We provide all our code and our final trained TabPFN in the supplementary materials.

This paper presents a new efficient black-box attribution method based on Hilbert-Schmidt Independence Criterion (HSIC), a dependence measure based on Reproducing Kernel Hilbert Spaces (RKHS). HSIC measures the dependence between regions of an input image and the output of a model based on kernel embeddings of distributions. It thus provides explanations enriched by RKHS representation capabilities. HSIC can be estimated very efficiently, significantly reducing the computational cost compared to other black-box attribution methods. Our experiments show that HSIC is up to 8 times faster than the previous best black-box attribution methods while being as faithful. Indeed, we improve or match the state-of-the-art of both black-box and white-box attribution methods for several fidelity metrics on Imagenet with various recent model architectures. Importantly, we show that these advances can be transposed to efficiently and faithfully explain object detection models such as YOLOv4. Finally, we extend the traditional attribution methods by proposing a new kernel enabling an orthogonal decomposition of importance scores based on HSIC, allowing us to evaluate not only the importance of each image patch but also the importance of their pairwise interactions.

This paper derives confidence intervals (CI) and time-uniform confidence sequences (CS) for the classical problem of estimating an unknown mean from bounded observations. We present a general approach for deriving concentration bounds, that can be seen as a generalization (and improvement) of the celebrated Chernoff method. At its heart, it is based on deriving a new class of composite nonnegative martingales, with strong connections to testing by betting and the method of mixtures. We show how to extend these ideas to sampling without replacement, another heavily studied problem. In all cases, our bounds are adaptive to the unknown variance, and empirically vastly outperform existing approaches based on Hoeffding or empirical Bernstein inequalities and their recent supermartingale generalizations. In short, we establish a new state-of-the-art for four fundamental problems: CSs and CIs for bounded means, when sampling with and without replacement.

Mechanistic models with differential equations are a key component of scientific applications of machine learning. Inference in such models is usually computationally demanding, because it involves repeatedly solving the differential equation. The main problem here is that the numerical solver is hard to combine with standard inference techniques. Recent work in probabilistic numerics has developed a new class of solvers for ordinary differential equations (ODEs) that phrase the solution process directly in terms of Bayesian filtering. We here show that this allows such methods to be combined very directly, with conceptual and numerical ease, with latent force models in the ODE itself. It then becomes possible to perform approximate Bayesian inference on the latent force as well as the ODE solution in a single, linear complexity pass of an extended Kalman filter / smoother - that is, at the cost of computing a single ODE solution. We demonstrate the expressiveness and performance of the algorithm by training, among others, a non-parametric SIRD model on data from the COVID-19 outbreak.

We introduce three adaptive time series learning methods, called Dynamic Model Selection (DMS), Adaptive Ensemble (AE), and Dynamic Asset Allocation (DAA). The methods respectively handle model selection, ensembling, and contextual evaluation in financial time series. Empirically, we use the methods to forecast the returns of four key indices in the US market, incorporating information from the VIX and Yield curves. We present financial applications of the learning results, including fully-automated portfolios and dynamic hedging strategies. The strategies strongly outperform long-only benchmarks over our testing period, spanning from Q4 2015 to the end of 2021. The key outputs of the learning methods are interpreted during the 2020 market crash.

Bagging and boosting are two popular ensemble methods in machine learning (ML) that produce many individual decision trees. Due to the inherent ensemble characteristic of these methods, they typically outperform single decision trees or other ML models in predictive performance. However, numerous decision paths are generated for each decision tree, increasing the overall complexity of the model and hindering its use in domains that require trustworthy and explainable decisions, such as finance, social care, and health care. Thus, the interpretability of bagging and boosting algorithms, such as random forest and adaptive boosting, reduces as the number of decisions rises. In this paper, we propose a visual analytics tool that aims to assist users in extracting decisions from such ML models via a thorough visual inspection workflow that includes selecting a set of robust and diverse models (originating from different ensemble learning algorithms), choosing important features according to their global contribution, and deciding which decisions are essential for global explanation (or locally, for specific cases). The outcome is a final decision based on the class agreement of several models and the explored manual decisions exported by users. We evaluated the applicability and effectiveness of VisRuler via a use case, a usage scenario, and a user study. The evaluation revealed that most users managed to successfully use our system to explore decision rules visually, performing the proposed tasks and answering the given questions in a satisfying way.

We consider the problem of maximizing a non-concave Lipschitz multivariate function over a compact domain by sequentially querying its (possibly perturbed) values. We study a natural algorithm designed originally by Piyavskii and Shubert in 1972, for which we prove new bounds on the number of evaluations of the function needed to reach or certify a given optimization accuracy. Our analysis uses a bandit-optimization viewpoint and solves an open problem from Hansen et al.\ (1991) by bounding the number of evaluations to certify a given accuracy with a near-optimal sum of packing numbers.

Eigenvector perturbation analysis plays a vital role in various data science applications. A large body of prior works, however, focused on establishing $\ell_{2}$ eigenvector perturbation bounds, which are often highly inadequate in addressing tasks that rely on fine-grained behavior of an eigenvector. This paper makes progress on this by studying the perturbation of linear functions of an unknown eigenvector. Focusing on two fundamental problems -- matrix denoising and principal component analysis -- in the presence of Gaussian noise, we develop a suite of statistical theory that characterizes the perturbation of arbitrary linear functions of an unknown eigenvector. In order to mitigate a non-negligible bias issue inherent to the natural ``plug-in'' estimator, we develop de-biased estimators that (1) achieve minimax lower bounds for a family of scenarios (modulo some logarithmic factor), and (2) can be computed in a data-driven manner without sample splitting. Noteworthily, the proposed estimators are nearly minimax optimal even when the associated eigen-gap is {\em substantially smaller} than what is required in prior statistical theory.

The standard supervised learning paradigm works effectively when training data shares the same distribution as the upcoming testing samples. However, this assumption is often violated in real-world applications, especially when testing data appear in an online fashion. In this paper, we formulate and investigate the problem of online label shift (OLaS): the learner trains an initial model from the labeled offline data and then deploys it to an unlabeled online environment where the underlying label distribution changes over time but the label-conditional density does not. The non-stationarity nature and the lack of supervision make the problem challenging to be tackled. To address the difficulty, we construct a new unbiased risk estimator that utilizes the unlabeled data, which exhibits many benign properties albeit with potential non-convexity. Building upon that, we propose novel online ensemble algorithms to deal with the non-stationarity of the environments. Our approach enjoys optimal dynamic regret, indicating that the performance is competitive with a clairvoyant who knows the online environments in hindsight and then chooses the best decision for each round. The obtained dynamic regret bound scales with the intensity and pattern of label distribution shift, hence exhibiting the adaptivity in the OLaS problem. Extensive experiments are conducted to validate the effectiveness and support our theoretical findings.  ( 2 min )

We propose a novel theoretical framework of analysis for Generative Adversarial Networks (GANs). We reveal a fundamental flaw of previous analyses which, by incorrectly modeling GANs' training scheme, are subject to ill-defined discriminator gradients. We overcome this issue which impedes a principled study of GAN training, solving it within our framework by taking into account the discriminator's architecture. To this end, we leverage the theory of infinite-width neural networks for the discriminator via its Neural Tangent Kernel. We characterize the trained discriminator for a wide range of losses and establish general differentiability properties of the network. From this, we derive new insights about the convergence of the generated distribution, advancing our understanding of GANs' training dynamics. We empirically corroborate these results via an analysis toolkit based on our framework, unveiling intuitions that are consistent with GAN practice.

Best subset selection is considered the `gold standard' for many sparse learning problems. A variety of optimization techniques have been proposed to attack this non-convex and NP-hard problem. In this paper, we investigate the dual forms of a family of $\ell_0$-regularized problems. An efficient primal-dual method has been developed based on the primal and dual problem structures. By leveraging the dual range estimation along with the incremental strategy, our algorithm potentially reduces redundant computation and improves the solutions of best subset selection. Theoretical analysis and experiments on synthetic and real-world datasets validate the efficiency and statistical properties of the proposed solutions.  ( 2 min )

Understanding how machine learning models generalize to new environments is a critical part of their safe deployment. Recent work has proposed a variety of complexity measures that directly predict or theoretically bound the generalization capacity of a model. However, these methods rely on a strong set of assumptions that in practice are not always satisfied. Motivated by the limited settings in which existing measures can be applied, we propose a novel complexity measure based on the local manifold smoothness of a classifier. We define local manifold smoothness as a classifier's output sensitivity to perturbations in the manifold neighborhood around a given test point. Intuitively, a classifier that is less sensitive to these perturbations should generalize better. To estimate smoothness we sample points using data augmentation and measure the fraction of these points classified into the majority class. Our method only requires selecting a data augmentation method and makes no other assumptions about the model or data distributions, meaning it can be applied even in out-of-domain (OOD) settings where existing methods cannot. In experiments on robustness benchmarks in image classification, sentiment analysis, and natural language inference, we demonstrate a strong and robust correlation between our manifold smoothness measure and actual OOD generalization on over 3,000 models evaluated on over 100 train/test domain pairs.  ( 3 min )

This paper develops simple feed-forward neural networks that achieve the universal approximation property for all continuous functions with a fixed finite number of neurons. These neural networks are simple because they are designed with a simple and computable continuous activation function $\sigma$ leveraging a triangular-wave function and the softsign function. We prove that $\sigma$-activated networks with width $36d(2d+1)$ and depth $11$ can approximate any continuous function on a $d$-dimensional hypercube within an arbitrarily small error. Hence, for supervised learning and its related regression problems, the hypothesis space generated by these networks with a size not smaller than $36d(2d+1)\times 11$ is dense in the continuous function space $C([a,b]^d)$ and therefore dense in the Lebesgue spaces $L^p([a,b]^d)$ for $p\in [1,\infty)$. Furthermore, classification functions arising from image and signal classification are in the hypothesis space generated by $\sigma$-activated networks with width $36d(2d+1)$ and depth $12$, when there exist pairwise disjoint bounded closed subsets of $\mathbb{R}^d$ such that the samples of the same class are located in the same subset. Finally, we use numerical experimentation to show that replacing the ReLU activation function by ours would improve the experiment results.  ( 3 min )

We consider minimizing a twice-differentiable, $L$-smooth, and $\mu$-strongly convex objective $\phi$ over an $n\times n$ positive semidefinite matrix $M\succeq0$, under the assumption that the minimizer $M^{\star}$ has low rank $r^{\star}\ll n$. Following the Burer--Monteiro approach, we instead minimize the nonconvex objective $f(X)=\phi(XX^{T})$ over a factor matrix $X$ of size $n\times r$. This substantially reduces the number of variables from $O(n^{2})$ to as few as $O(n)$ and also enforces positive semidefiniteness for free, but at the cost of giving up the convexity of the original problem. In this paper, we prove that if the search rank $r\ge r^{\star}$ is overparameterized by a constant factor with respect to the true rank $r^{\star}$, namely as in $r>\frac{1}{4}(L/\mu-1)^{2}r^{\star}$, then despite nonconvexity, local optimization is guaranteed to globally converge from any initial point to the global optimum. This significantly improves upon a previous rank overparameterization threshold of $r\ge n$, which is known to be sharp if $\phi$ is allowed to be nonsmooth and/or non-strongly convex, but would increase the number of variables back up to $O(n^{2})$. Conversely, without rank overparameterization, we prove that such a global guarantee is possible if and only if $\phi$ is almost perfectly conditioned, with a condition number of $L/\mu<3$. Therefore, we conclude that a small amount of overparameterization can lead to large improvements in theoretical guarantees for the nonconvex Burer--Monteiro factorization.

Generative Adversarial Networks (GANs) learn an implicit generative model from data samples through a two-player game. In this paper, we study the existence of Nash equilibrium of the game which is consistent as the number of data samples grows to infinity. In a realizable setting where the goal is to estimate the ground-truth generator of a stationary Gaussian process, we show that the existence of consistent Nash equilibrium depends crucially on the choice of the discriminator family. The discriminator defined from second-order statistical moments can result in non-existence of Nash equilibrium, existence of consistent non-Nash equilibrium, or existence and uniqueness of consistent Nash equilibrium, depending on whether symmetry properties of the generator family are respected. We further study the local stability and global convergence of gradient descent-ascent methods towards consistent equilibrium.

We consider the problem of sequential evaluation, in which an evaluator observes candidates in a sequence and assigns scores to these candidates in an online, irrevocable fashion. Motivated by the psychology literature that has studied sequential bias in such settings -- namely, dependencies between the evaluation outcome and the order in which the candidates appear -- we propose a natural model for the evaluator's rating process that captures the lack of calibration inherent to such a task. We conduct crowdsourcing experiments to demonstrate various facets of our model. We then proceed to study how to correct sequential bias under our model by posing this as a statistical inference problem. We propose a near-linear time, online algorithm for this task and prove guarantees in terms of two canonical ranking metrics. We also prove that our algorithm is information theoretically optimal, by establishing matching lower bounds in both metrics. Finally, we show that our algorithm outperforms the de facto method of using the rankings induced by the reported scores.

Graph neural networks (GNNs) have gained traction over the past few years for their superior performance in numerous machine learning tasks. Graph Convolutional Neural Networks (GCN) are a common variant of GNNs that are known to have high performance in semi-supervised node classification (SSNC), and work well under the assumption of homophily. Recent literature has highlighted that GCNs can achieve strong performance on heterophilous graphs under certain "special conditions". These arguments motivate us to understand why, and how, GCNs learn to perform SSNC. We find a positive correlation between similarity of latent node embeddings of nodes within a class and the performance of a GCN. Our investigation on underlying graph structures of a dataset finds that a GCN's SSNC performance is significantly influenced by the consistency and uniqueness in neighborhood structure of nodes within a class.

An interesting article in the Systematic Biology journal about identifying insects: https://academic.oup.com/sysbio/article/68/6/876/5368535 See as well: Deep learning and computer vision will transform entomology submitted by /u/1_like_science [link] [comments]  ( 85 min )

In the formal logic based autonomous driving dataset, we have a set of rules usually written in First order logic or temporal logic . But to apply the rules, we need to extract the predicate from perception system. For example, how to attach the predicate like standing_at_intersection with the perception scene obtained from AD dataset like Lyft or Argoverse or CARLA simulator. So that I can apply rules on those specific scenario. I could not find any papers or explanation, which explains how to connect the predicate in formal logic and match the connecting predicate with the dataset scene interpretation. Any help is appreciated or links to resource. submitted by /u/projekt_treadstone [link] [comments]  ( 86 min )

I've been assigned at work a problem with multiple targets, and I've been thinking about what's the best to design a model that would optimize towards all these targets. An idea that occurred me is to create a reward function that would "encapsulate" all these targets in such a way where, the higher the reward, the better the outcome is for all the targets. In my case, it's a task distribution system where the workers have the option to decline a task if for whatever reason the task doesn't suit them, and one of my targets is to minimize the number of declines. But we also need to make sure the workload is balanced, and we are not overwhelming someone while under-utilizing the rest of the team; that would be my second target, and we can use the standard deviation as a way to measure the workload balance (the closer to 0 the std is, the better). Essentially, the targets we want to optimize towards are, reduce the number of declines, and also reduce the std of the overall task distribution. So, my reward function could be: - score 0 if the task is declined; - if the task is accepted, then I can take the delta of the std before and after. The bigger the delta, the more std was reduced, so the more even the distribution became. That way, the reward score would in a way represent both my targets (and would be the labels), and then it's simply a matter of training a regression model. Then for a new task, I predict the reward score for each task and worker, and finally assign the tasks by taking the argmax of the predicted scores. I know that rewards are popular in the RL field, but this wouldn't be necessarily a RL problem. In fact, I googled this idea but the vast majority of articles and papers covering reward functions are RL-related. I'm wondering if anyone has tried anything like this before, or have any thoughts. All comments are appreciated. submitted by /u/Travolta1984 [link] [comments]  ( 87 min )

Prompted by a recent discussion on social media, I did some benchmarks and wrote down my thoughts on why it doesn't really make a difference whether we choose batch sizes as powers of 2: https://sebastianraschka.com/blog/2022/batch-size-2.html What is your experience, do you do you stick to batch sizes as powers of 2 or do you choose batch sizes more freely? notice a substantial difference when you choose batch sizes as powers of 2 (or multiples of 8)? submitted by /u/seraschka [link] [comments]  ( 92 min )

First of all, using the cloud is not a cost effective solution for us. We have an absolute beast of a server though everything grounds down to a halt when some training sessions are going on - some libraries just ignore the num_cpu settings and uses all the cpu (and even when more cores are free, everything seems to get much slower) Here's the build: 2x AMD EPYC 7763 (64 cores, 2 threads each) 2TB memory 8 RTX A6000 4TB SSD (NVMe) How do you all share a single computer resource amongst other co-workers? We have this expensive machine but when someone runs their training, others have a hard time running basic pandas operations (starting other training jobs just slows down ALL training jobs). To me, it seems like the hardware should be more than enough to run multiple training jobs concurrently. Any tips on how to use it efficiently? One solution I've been thinking was to use docker for each training job and to put hard limits on cpu / memory usage - is this something closer to best practice? submitted by /u/tadf2 [link] [comments]  ( 87 min )

Hello everyone! I updated the concrete dropout implementation from the original authors to work with tensorflow 2.0, tweaked the code a bit and turned it into a pip package! If you are interested, you can find it at pypi by sarching "concretedropout". There is also a link in the comments. For those of you who don't know what concrete dropout is, it's a technique which allows for the training of the dropout probability in a layer, which may save a lot of time since it removes the need to grid search for the best dropout parameters. For more information, see the original paper: arXiv:1705.07832 submitted by /u/TrPhantom8 [link] [comments]  ( 88 min )

Currently, we use google as our OCR service provider, but we've had already some serious issues with them and their customer support is terrible. Therefore we would like to change and move away from third-party providers in general. By now we have a sufficient amount of data to train our own OCR model, therefore I am looking for a custom fine-tunable model that is fast/accurate. I've found PaddleOCR and mmocr, but their inference speed for documents like invoices on CPU is quite slow (10s/page on my computer). I'm looking for something in the 1s/page range, similar to google's OCR. We probably don't need all the power and language knowledge these libraries provide, as we only operate on documents in mainly 4 Latin languages. Does anybody know a good starting point? submitted by /u/mkeySeraSera [link] [comments]  ( 87 min )

I'm currently using different machine learning techniques on a time series and testing their forecast performance. This dataset has both an independent variable and exploratory variables. I've used LSTM on python to forecast and was searching for more recent techniques and found transformers. They seem to have been developed for NLP but have been used for time-series forecasts How well do these transformers perform and is there any resources / library I should look into? EDIT: the data I'll be using is of daily periodicity without weekends. It will have 2+ years of observations (currently working with 3 years and some other datasets have longer periods but "worse" information) submitted by /u/DoruSonic [link] [comments]  ( 90 min )

Does anyone know how to register for the WACV 2023 conference? submitted by /u/jeryyjohnson [link] [comments]  ( 85 min )

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I have just graduated from school and I wanted to major in AI engineering, unfortunately, I found out that I can't, even for close majors like computer science. The only two options I have now lie between Software Engineering and Computer Engineering, which are both far from my interests, such as: AI, Machine Learning, Simulations, 3D Engines. My second plan is now to get a master's degree in AI after finishing my bachelors degree in one of these two majors I mentioned, which I later could afford on my own with their job prospects. My problem with Software Engineering is that it's too restrictive and I'm not a big fan of making software, apps and websites, but I know two friends who have already majored in it. For Computer Engineering, it does seem more interesting, the making of hardware components, but it does include Electrical Engineering, which I'm NOT a fan of. My view on majors other than AI is pretty superficial, so not claiming to have made an educated opinion on what to opt. Do I have to go with Software Engineering or Computer Engineering according to my plan and interests? I'm open for opinions, even if there's other majors than these two! submitted by /u/CATEXEBRAIN [link] [comments]  ( 88 min )

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​ This infographic shows the many ways in which AI is transforming business as well as leading job roles created by this change and top skills needed to ride the AI wave. submitted by /u/Emily-joe [link] [comments]  ( 84 min )

Brain-Supervised Image Editing Despite recent advances in deep neural models for semantic image editing, present approaches are dependent on explicit human input. Previous work assumes the availability of manually curated datasets for supervised learning, while for unsupervised approaches the human inspection of discovered components is required to identify those which modify worthwhile semantic features. Here, we present a novel alternative: the utilization of brain responses as a supervision signal for learning semantic feature representations. Participants (N=30) in a neurophysiological experiment were shown artificially generated faces and instructed to look for a particular semantic feature, such as "old" or "smiling", while their brain responses were recorded via electroencephalog…  ( 92 min )

Up until recently with projects like LaMDA and BlenderBot, the area of open ended conversational AI has either been completely untouched or kept purely as research. Very few of these projects have actually been used in applications for just having a two way conversation with a user. For people in the field, why is this the case? Do companies not see a path forward with open ended dialogue systems? submitted by /u/holamyeung [link] [comments]  ( 89 min )

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Hi all, so TRPO enforces a constraint on the approximated KL divergence (which is clear to me). However, I was wondering why they solve such a constrained optimization problem using the "hard way" (i.e., a linear approx. on the objective and the quadratic one on the constraint), when they could have used a simpler Lagrangian dual. Is there any advantage in doing that over using a Lagrangian? Thanks! submitted by /u/Beautiful_Zebra_198 [link] [comments]  ( 84 min )

Check, if and (if so) where in the Monte-Carlo algorithm, Temporal Difference learning (TD(0)), the Dyna-Q architecture, and R-Max a static environment is implicitly assumed. How could you modify the relevant learning methods so that they can in principle adapt to changing environments? It can be assumed that ε is sufficiently large. submitted by /u/Garbage-Shoddy [link] [comments]  ( 84 min )

Hi, I'm trying to learn a goal conditioned policy (a policy that make an agent reach a goal, that change at each episode) on ant maze (the mujoco one). This task looks really tough, I easily learned that king of policy on a grid world but my agent (tried with SAC and DDPG) failed to find a goal-conditioned policy in d4RL. Even the DDPG code given buy D4RL authors fail to do it.Did anybody here already did it? Do you have any git repository to share with me, or any tips? Thanks a lot in advance. Links:D4RL environments: https://github.com/rail-berkeley/d4rl D4RL DDPG implementation I'm talking about: https://github.com/rail-berkeley/d4rl_evaluations/tree/master/bcq/continuous_bcq submitted by /u/hbonnavaud [link] [comments]  ( 85 min )

That you do not have time to get bored by watching it in real time. So it sounds like a challenge: Does any of you knows a faster learning algorithm for gym CartPole? Sorry the repository is messy, cartpole_play.py is the main file its local dependencies are sdr_util.py, sdr_value_map.py - these are all what is needed its global dependencies are numpy, numba, gym and pygame if you want rendering. A short explanation of the algorithm: after each fall, two bit pair correlation value maps are updated to chart dangerous states in its environment then picks the least dangerous action at every step. Somewhat like a Q-Table yet quite efficient since it highlights specific value correlations between different state parameters that are most significant. submitted by /u/blimpyway [link] [comments]  ( 84 min )

From the papers I've read, it seems like all the existing methods (AlphaGo, AlphaGo Zero, MuZero, EfficientZero) uses MCTS at some point. Are there methods that doesn't perform search (i.e. directly predict action from state only, maybe with something like Policy Gradients) that have been shown to reach human level performance at chess ? submitted by /u/Lairv [link] [comments]  ( 90 min )

Facebook’s announcement last year about creating the Metaverse (and subsequent rebranding to Meta) kicked off a great deal of PR from the tech industry as everyone from established game companies to decentralized finance wildcats raced to plant their flag in the ground. Roughly a year has passed and in the interim the initial fervor has… Read More »DSC Weekly 05 July 2022: Standardizing a Metaverse The post DSC Weekly 05 July 2022: Standardizing a Metaverse appeared first on Data Science Central.  ( 20 min )

I am honored to collaborate on this week’s blog with Fran Willis White, an industry expert on the role of change leadership and employee empowerment to drive cultural transformation.  In collaborating on this blog, I discovered many similarities in the role of empowerment in the data science development process to optimize business outcomes, as well… Read More »Wanna become Value-driven? Time for a Culture Shift! The post Wanna become Value-driven? Time for a Culture Shift! appeared first on Data Science Central.  ( 19 min )

Data Science is a growing field that has emerged in many key areas of our world. Data Science has become a global phenomenon and has significantly improved the performance of many industries. Data Science has even incorporated education under its umbrella. Today we will be discussing the importance of data science for education & some… Read More »Education Trends 2022: Data Science in schools The post Education Trends 2022: Data Science in schools appeared first on Data Science Central.  ( 20 min )

Last week, Databricks open sourced all of Delta Lake (Delta Lake 2.0) to the Linux Foundation.  There is also a new release of MLflow (MLflow 2.0), which is a machine learning operations platform for management of ML pipelines.  In Databricks parlance, a Delta Lake represents a data architecture that has both storage and analytics capabilities; … Read More »Databricks open sourcing delta lake is good news for AI  The post Databricks open sourcing delta lake is good news for AI  appeared first on Data Science Central.  ( 17 min )

If you use the default lifecycle configuration for your domain or user profile in Amazon SageMaker Studio and use Amazon SageMaker Data Wrangler for data preparation, then this post is for you. In this post, we show how you can create a Data Wrangler flow and use it for data preparation in a Studio environment […]  ( 8 min )

Socially disadvantaged communities have often raised legitimate concerns about being over-policed and under-protected. Now, the rise of AI…  ( 12 min )

Since a customized AI solution is always individual, no one can give you a general cost estimate.  ( 8 min )

Putting art, mathematics and computers together in the mid-1980s created a new genre of digital media: fractal art. In the NVIDIA Studio this week, computer graphics (CG) artist, educator and curator Xueguo Yang shares his insights behind fractal art — which uses algorithms to artistically represent calculations derived from geometric objects as digital images and animations. The post Computer Graphics Artist Xueguo Yang Shares Fractal Art Series This Week ‘In the NVIDIA Studio’ appeared first on NVIDIA Blog.  ( 7 min )

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The study on explainability or explainable AI is currently receiving a lot of attention as DNNs become accessible in a variety of application domains. Many explainability techniques that attempt to provide the local explanation of the DNNs prediction for a particular instance, such as techniques that provide saliency maps for understanding which sub-parts in an instance are most responsible for the model prediction, have been proposed in an effort to open the black box of DNNs. While local explanation techniques have seen a rapid growth in research in recent years, the majority of attention has been placed on handling the generation of explanations rather than understanding whether the explanations are accurate or reasonable, what to do if they are, and how to modify the model to produce more accurate or reasonable explanations. Continue reading | Checkout the paper and github submitted by /u/ai-lover [link] [comments]  ( 84 min )

Artificially intelligent models have recently advanced to the point that users will soon be able to utilize these models to immediately construct and alter nearly photorealistic three-dimensional sceneries from the comfort of their laptops. Since these technologies make it simple to generate hyperrealistic avatars, they will revolutionize the way artists working on video games and CGI for movies approach their work. For quite some time, AIs have been able to create realistic 2D images. However, 3D scenarios have proven to be more challenging due to the enormous computer power needed. The AI model EG3D, created by a team of Stanford academics, can be used to produce random high-resolution images of faces and other things having an underlying geometric structure. This model is one of the first 3D models now in use to reach rendering quality close to photorealism. Continue reading | Checkout the paper, github submitted by /u/ai-lover [link] [comments]  ( 84 min )

Why is there a Nobel Prize? The Nobel Prize was set up when businessman and entrepreneur Alfred Nobel died and left the majority of his fortune to the establishment of prizes in physics, chemistry, physiology or medicine, literature and peace. His will stated that the prizes should be awarded to “those who, during the preceding year, shall have conferred the greatest benefit to humankind.” [source: https://www.nobelprize.org ] I think AI technologies are everywhere; in physics, chemistry, physiology, medicine, literature, peace, etc. The Nobel Peace Prize foundation should dedicate a prize to AI researchers who invent technologies that change human life. Who agrees? submitted by /u/aymenSekhri [link] [comments]  ( 83 min )

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Ever wondered could we learn python in the browser and run machine learning apps?. Recently I came to know about PyScript which can be used to run python in the browser. Still, I couldn't find a single example or post which demonstrates image processing using PyScript hence I decided to figure it out myself, and create one and share it with the community. The article doing the same can be checked from link below: https://blog.devgenius.io/bringing-python-to-browser-for-doing-image-processing-c34f5bba9c1d submitted by /u/VikasOjha666 [link] [comments]  ( 83 min )

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https://codingvidya.com/best-artificial-intelligence-courses-for-healthcare/ submitted by /u/Lakshmireddys [link] [comments]  ( 82 min )

TL;DR: Check out Poniard, a new Python library that helps with machine learning model evaluation. You can go ahead and install with pip. Links to source code and documentation at the end of this post. ----- For the past few months I've been working on Poniard, a Python library that streamlines ML model evaluation and comparison, built on top of scikit-learn. In a nutshell, load some data, select some models, some metrics and a cross-validation strategy, and go to town. Poniard tries to have a small footprint, a simple API and sane defaults. But above all it strives to have the user stay in control of their modeling experience; you should always know what's going on. This deliberately is NOT an AutoML tool When I started this project I was trying to speed up a very uninteresting process, i.e., loop through multiple estimators and arrive at a list of metrics for comparison. On the way I included easy hyperparameter tuning, plotting, an extensible plugin framework (out of the box includes Weights and Biases and Pandas Profiling) and as much as I could to make the experience simple and transparent. Poniard is not exactly groundbreaking, and there are projects in a similar vein that do so much more. In contrast, they tend to have a more complicated API and more dependencies which are some of the things that I actively tried to avoid. Github Example notebooks (including Colab links) Documentation PyPI submitted by /u/rafa10pj [link] [comments]  ( 85 min )

https://textgenerator.app.nz/bulk-text-generator You can upload a CSV and get lots of Text Generated, works in many languages and code too. There's also an API. The main selling points (VS OpenAI who is the main competitor) Works faster Currie/Babbage quality, but also works across languages/code without needing to specify what model Massively cheaper pricing/huge cost savings :) easier to control can specify max_sentences to make it generate up to a specific number of sentences) can specify min_probability to make it generate the next few likely words to do autocomplete for code/writing I originally created https://textgenerator.app.nz/ as a API for developers primarily but the bulk generator now allows non technical types to pre generate a lot of variety too/branching stories/games/marketing content/code/summaries/ etc. There's actually a massive amount of use cases that one will never be able to understand which is exciting too. submitted by /u/leepenkman [link] [comments]  ( 86 min )

I am working on a research project about controllable generation with GPT. I am stuck, so I hope you are able to help me out. I will try to explain the issue as clear as possible, so bear with me. The approach I am pursuing right now is adding a frozen classifier on top of gpt that should steer the model in generating the right class, which is a grammatical property of the generated output. However, the autoregressive nature of GPT complicates things a bit. I cannot simply backpropagate through the generation process (greedy / beam search). I tried adding the classifier on the last input token to avoid the generation process but unsurprisingly this does not yield sufficient performance. How would you tackle this? Is it even feasible? submitted by /u/_Arsenie_Boca_ [link] [comments]  ( 85 min )

In my research I recently came across this library from google: seqio: Task-based datasets, preprocessing, and evaluation for sequence models. From the citation it seems it was released jointly with another library from google, t5x. From the paper and the docs, it sounds quite similar to huggingface's datasets library, albeit perhaps slightly more opinionated. I was hoping to find a more thorough comparison with pre-existing dataloading/processing libraries but couldn't find one (they mostly focus on t5x in the paper). Has anyone here used it? What was your experience? To me it seems a bit redundant but I haven't been able to take a deeper dive Thanks :) submitted by /u/thesofakillers [link] [comments]  ( 84 min )

Looking for a bit of a discussion. I'm wondering how you collaborate on data... i.e. how do you share big datasets with data scientists/engineers, within and outside of your team? Do you just push it into a simple DB, do you upload it to Kaggle (if non-sensitive) or via Google Drive/OneDrive? What if the dataset gets updated frequently? I'm working with a customer and sharing data is a bit of a pain. submitted by /u/dmart89 [link] [comments]  ( 91 min )

A blog about representation learning from masked images, what makes a good mask, and how to learn such masks: https://akosiorek.github.io/ml/2022/07/04/masking_repr_learning_vision.html. Based on a recent ICML paper: Shi et. al, "Adversarial Masking for Self-Supervised Learning", ICML 2022. submitted by /u/ErrorDry4380 [link] [comments]  ( 84 min )

Hi everyone! We are engineers from Microsoft/LinkedIn, and we released an open-source Feature Store called Feathr a few weeks ago (https://github.com/linkedin/feathr). It has many highlights like below. Feel free to check out the repository and let us know if there are any questions! We also have a few blogposts and recordings in case folks want to learn a bit more about it: Open Sourcing Feathr Feathr on Azure. Tech talks on Feathr And its highlights include (more highlights are here): Battle tested in production for more than 6 years: LinkedIn has been using Feathr in production for over 6 years and have a dedicated team improving it. Scalable with built-in optimizations: For example, based on some internal use case, Feathr can process billions of rows and PB scale data with built-in optimizations such as bloom filters and salted joins. Rich support for point-in-time joins and aggregations: Feathr has high performant built-in operators designed for Feature Store, including time-based aggregation, sliding window joins, look-up features, all with point-in-time correctness. Derived Features and centralized Feature Registry which encourage feature consumers to build features on existing features and encouraging feature reuse. ​ Screenshots for the Feathr UI: https://preview.redd.it/3fri2r3qoi991.png?width=3584&format=png&auto=webp&s=5dfe14233b2a8805c50bedd5bfed4bbb31bd0654 submitted by /u/zxzxy1988 [link] [comments]  ( 86 min )

Dealing with a very huge data, eg. very long video datasets, the problems are long training time. Most of technics are using distributed deep learning to solve the problem robustly. I have an idea that we divide the dataset into small sets and train a model. After that using the model to predict values as features, put them into another model and train a second model to predict the output. Like divide and conquer but here is divide the dataset, train a model and conquer the prediction results into one. I have done some research in the internet about deep learning algorithm based on divide and conquer but seems not so many articles about it. Is it a correct to think in this way? Does anyone know any paper about this? Thank you so much. submitted by /u/tmclouisluk [link] [comments]  ( 91 min )

Although there are university rankings such as us news, it is difficult to find the universities that are good at a specific field one is interested in. We all know that Stanford and Berkeley are good at generative models, but what else? Please give me the name of university (+ the name of professor if possible) and the paper they published. It would be meaningful especially if the university is not very famous and their paper is outstanding. submitted by /u/SnooPandas3529 [link] [comments]  ( 85 min )

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Here's the update for week 2 of reading the book! ​ This weeks reading is also quite short with 17 pages, that's barely 2.5 pages per day! The chapter covers the first basic concepts and the gradient bandit algorithms. As far as live discussions goes, a Discord Server has been created just for this purpose. See https://discord.gg/Juafpk23 (Thanks u/duh619 for creating the channel). Use Discord at your own discretion though. (https://spyware.neocities.org/articles/discord.html) The plan is to have weekly discussions - the search for a common time slot is ongoing until tomorrow night. ​ To supplement your reading, you can find summaries of the chapters on Youtube: https://www.youtube.com/watch?v=4SLGEq_HZxk&list=PLnn6VZp3hqNvRrdnMOVtgV64F_O-61C1D&index=1 (Thanks to u/taplik_to_rehvani for pointing this out). ​ Happy Reading, hope to see some comments discussing questions and ideas of this weeks chapter! submitted by /u/Accomplished-Ninja31 [link] [comments]  ( 83 min )

So bear with me here, I have some experience in other types of ML, but I don't really know much about RL. I have a problem where I want to use a neutral network to see some history of inputs, choose a set of parameters, and then that set of parameters modifies a simulation that eventually spits back a loss. This is all a time series, so those losses can either be viewed per sample or be batched up in some way. Anyway, to me it seems RL in general has to deal with interacting with some big unknown external system (the "environment"). However, in my scenario, that simulation is actually a relatively straightforward algorithm that I've already implemented in PyTorch and is differentiable. Does this buy me anything that "normal RL" has to hack its way around? Any insights here are greatly appreciated. Thanks in advance. submitted by /u/saw79 [link] [comments]  ( 85 min )

I am wondering how it makes sense to add noise in state-space during the training process at random times. submitted by /u/Mariam_Dundua [link] [comments]  ( 83 min )

Machine learning models exhibit two seemingly contradictory phenomena: training data memorization and various forms of forgetting. In memorization, models overfit specific training examples and become susceptible to privacy attacks. In forgetting, examples which appeared early in training are forgotten by the end. In this work, we connect these phenomena. We propose a technique to measure to what extent models ``forget'' the specifics of training examples, becoming less susceptible to privacy attacks on examples they have not seen recently. We show that, while non-convexity can prevent forgetting from happening in the worst-case, standard image and speech models empirically do forget examples over time. We identify nondeterminism as a potential explanation, showing that deterministically trained models do not forget. Our results suggest that examples seen early when training with extremely large datasets -- for instance those examples used to pre-train a model -- may observe privacy benefits at the expense of examples seen later.  ( 2 min )

We make the first steps towards generalizing the theory of stochastic block models, in the sparse regime, towards a model where the discrete community structure is replaced by an underlying geometry. We consider a geometric random graph over a homogeneous metric space where the probability of two vertices to be connected is an arbitrary function of the distance. We give sufficient conditions under which the locations can be recovered (up to an isomorphism of the space) in the sparse regime. Moreover, we define a geometric counterpart of the model of flow of information on trees, due to Mossel and Peres, in which one considers a branching random walk on a sphere and the goal is to recover the location of the root based on the locations of leaves. We give some sufficient conditions for percolation and for non-percolation of information in this model.  ( 2 min )

Semantic image interpretation can vastly benefit from approaches that combine sub-symbolic distributed representation learning with the capability to reason at a higher level of abstraction. Logic Tensor Networks (LTNs) are a class of neuro-symbolic systems based on a differentiable, first-order logic grounded into a deep neural network. LTNs replace the classical concept of training set with a knowledge base of fuzzy logical axioms. By defining a set of differentiable operators to approximate the role of connectives, predicates, functions and quantifiers, a loss function is automatically specified so that LTNs can learn to satisfy the knowledge base. We focus here on the subsumption or \texttt{isOfClass} predicate, which is fundamental to encode most semantic image interpretation tasks. Unlike conventional LTNs, which rely on a separate predicate for each class (e.g., dog, cat), each with its own set of learnable weights, we propose a common \texttt{isOfClass} predicate, whose level of truth is a function of the distance between an object embedding and the corresponding class prototype. The PROTOtypical Logic Tensor Networks (PROTO-LTN) extend the current formulation by grounding abstract concepts as parametrized class prototypes in a high-dimensional embedding space, while reducing the number of parameters required to ground the knowledge base. We show how this architecture can be effectively trained in the few and zero-shot learning scenarios. Experiments on Generalized Zero Shot Learning benchmarks validate the proposed implementation as a competitive alternative to traditional embedding-based approaches. The proposed formulation opens up new opportunities in zero shot learning settings, as the LTN formalism allows to integrate background knowledge in the form of logical axioms to compensate for the lack of labelled examples.  ( 3 min )

Due to its high sample complexity, simulation is, as of today, critical for the successful application of reinforcement learning. Many real-world problems, however, exhibit overly complex dynamics, which makes their full-scale simulation computationally slow. In this paper, we show how to decompose large networked systems of many agents into multiple local components such that we can build separate simulators that run independently and in parallel. To monitor the influence that the different local components exert on one another, each of these simulators is equipped with a learned model that is periodically trained on real trajectories. Our empirical results reveal that distributing the simulation among different processes not only makes it possible to train large multi-agent systems in just a few hours but also helps mitigate the negative effects of simultaneous learning.  ( 2 min )

In post-silicon validation, tuning is to find the values for the tuning knobs, potentially as a function of process parameters and/or known operating conditions. In this sense, an more efficient tuning requires identifying the most critical tuning knobs and process parameters in terms of a given figure-of-merit for a Device Under Test (DUT). This is often manually conducted by experienced experts. However, with increasingly complex chips, manual inspection on a large amount of raw variables has become more challenging. In this work, we leverage neural networks to efficiently select the most relevant variables and present a corresponding deep-learning-aided pipeline for efficient tuning.  ( 2 min )

As deep learning is widely used in the radiology field, the explainability of such models is increasingly becoming essential to gain clinicians' trust when using the models for diagnosis. In this research, three experiment sets were conducted with a U-Net architecture to improve the classification performance while enhancing the heatmaps corresponding to the model's focus through incorporating heatmap generators during training. All of the experiments used the dataset that contained chest radiographs, associated labels from one of the three conditions ("normal", "congestive heart failure (CHF)", and "pneumonia"), and numerical information regarding a radiologist's eye-gaze coordinates on the images. The paper (A. Karargyris and Moradi, 2021) that introduced this dataset developed a U-Net model, which was treated as the baseline model for this research, to show how the eye-gaze data can be used in multi-modal training for explainability improvement. To compare the classification performances, the 95% confidence intervals (CI) of the area under the receiver operating characteristic curve (AUC) were measured. The best method achieved an AUC of 0.913 (CI: 0.860-0.966). The greatest improvements were for the "pneumonia" and "CHF" classes, which the baseline model struggled most to classify, resulting in AUCs of 0.859 (CI: 0.732-0.957) and 0.962 (CI: 0.933-0.989), respectively. The proposed method's decoder was also able to produce probability masks that highlight the determining image parts in model classifications, similarly as the radiologist's eye-gaze data. Hence, this work showed that incorporating heatmap generators and eye-gaze information into training can simultaneously improve disease classification and provide explainable visuals that align well with how the radiologist viewed the chest radiographs when making diagnosis.  ( 3 min )

Standard plane (SP) localization is essential in routine clinical ultrasound (US) diagnosis. Compared to 2D US, 3D US can acquire multiple view planes in one scan and provide complete anatomy with the addition of coronal plane. However, manually navigating SPs in 3D US is laborious and biased due to the orientation variability and huge search space. In this study, we introduce a novel reinforcement learning (RL) framework for automatic SP localization in 3D US. Our contribution is three-fold. First, we formulate SP localization in 3D US as a tangent-point-based problem in RL to restructure the action space and significantly reduce the search space. Second, we design an auxiliary task learning strategy to enhance the model's ability to recognize subtle differences crossing Non-SPs and SPs in plane search. Finally, we propose a spatial-anatomical reward to effectively guide learning trajectories by exploiting spatial and anatomical information simultaneously. We explore the efficacy of our approach on localizing four SPs on uterus and fetal brain datasets. The experiments indicate that our approach achieves a high localization accuracy as well as robust performance.  ( 3 min )

In this paper we consider the machine learning (ML) task of predicting tipping point transitions and long-term post-tipping-point behavior associated with the time evolution of an unknown (or partially unknown), non-stationary, potentially noisy and chaotic, dynamical system. We focus on the particularly challenging situation where the past dynamical state time series that is available for ML training predominantly lies in a restricted region of the state space, while the behavior to be predicted evolves on a larger state space set not fully observed by the ML model during training. In this situation, it is required that the ML prediction system have the ability to extrapolate to different dynamics past that which is observed during training. We investigate the extent to which ML methods are capable of accomplishing useful results for this task, as well as conditions under which they fail. In general, we found that the ML methods were surprisingly effective even in situations that were extremely challenging, but do (as one would expect) fail when ``too much" extrapolation is required. For the latter case, we investigate the effectiveness of combining the ML approach with conventional modeling based on scientific knowledge, thus forming a hybrid prediction system which we find can enable useful prediction even when its ML-based and knowledge-based components fail when acting alone. We also found that achieving useful results may require using very carefully selected ML hyperparameters and we propose a hyperparameter optimization strategy to address this problem. The main conclusion of this paper is that ML-based approaches are promising tools for predicting the behavior of non-stationary dynamical systems even in the case where the future evolution (perhaps due to the crossing of a tipping point) includes dynamics on a set outside of that explored by the training data.  ( 3 min )

Continual Learning (CL) on time series data represents a promising but under-studied avenue for real-world applications. We propose two new CL benchmarks for Human State Monitoring. We carefully designed the benchmarks to mirror real-world environments in which new subjects are continuously added. We conducted an empirical evaluation to assess the ability of popular CL strategies to mitigate forgetting in our benchmarks. Our results show that, possibly due to the domain-incremental properties of our benchmarks, forgetting can be easily tackled even with a simple finetuning and that existing strategies struggle in accumulating knowledge over a fixed, held-out, test subject.  ( 2 min )

Understanding vision and language representations of product content is vital for search and recommendation applications in e-commerce. As a backbone for online shopping platforms and inspired by the recent success in representation learning research, we propose a contrastive learning framework that aligns language and visual models using unlabeled raw product text and images. We present techniques we used to train large-scale representation learning models and share solutions that address domain-specific challenges. We study the performance using our pre-trained model as backbones for diverse downstream tasks, including category classification, attribute extraction, product matching, product clustering, and adult product recognition. Experimental results show that our proposed method outperforms the baseline in each downstream task regarding both single modality and multiple modalities.  ( 2 min )

Deep segmentation models often face the failure risks when the testing image presents unseen distributions. Improving model robustness against these risks is crucial for the large-scale clinical application of deep models. In this study, inspired by human learning cycle, we propose a novel online reflective learning framework (RefSeg) to improve segmentation robustness. Based on the reflection-on-action conception, our RefSeg firstly drives the deep model to take action to obtain semantic segmentation. Then, RefSeg triggers the model to reflect itself. Because making deep models realize their segmentation failures during testing is challenging, RefSeg synthesizes a realistic proxy image from the semantic mask to help deep models build intuitive and effective reflections. This proxy translates and emphasizes the segmentation flaws. By maximizing the structural similarity between the raw input and the proxy, the reflection-on-action loop is closed with segmentation robustness improved. RefSeg runs in the testing phase and is general for segmentation models. Extensive validation on three medical image segmentation tasks with a public cardiac MR dataset and two in-house large ultrasound datasets show that our RefSeg remarkably improves model robustness and reports state-of-the-art performance over strong competitors.  ( 2 min )

In this report, we introduce our adaptation of image-text models for long-term action anticipation. Our Video + CLIP framework makes use of a large-scale pre-trained paired image-text model: CLIP and a video encoder Slowfast network. The CLIP embedding provides fine-grained understanding of objects relevant for an action whereas the slowfast network is responsible for modeling temporal information within a video clip of few frames. We show that the features obtained from both encoders are complementary to each other, thus outperforming the baseline on Ego4D for the task of long-term action anticipation. Our code is available at github.com/srijandas07/clip_baseline_LTA_Ego4d.  ( 2 min )

Navigation inside luminal organs is an arduous task that requires non-intuitive coordination between the movement of the operator's hand and the information obtained from the endoscopic video. The development of tools to automate certain tasks could alleviate the physical and mental load of doctors during interventions, allowing them to focus on diagnosis and decision-making tasks. In this paper, we present a synergic solution for intraluminal navigation consisting of a 3D printed endoscopic soft robot that can move safely inside luminal structures. Visual servoing, based on Convolutional Neural Networks (CNNs) is used to achieve the autonomous navigation task. The CNN is trained with phantoms and in-vivo data to segment the lumen, and a model-less approach is presented to control the movement in constrained environments. The proposed robot is validated in anatomical phantoms in different path configurations. We analyze the movement of the robot using different metrics such as task completion time, smoothness, error in the steady-state, and mean and maximum error. We show that our method is suitable to navigate safely in hollow environments and conditions which are different than the ones the network was originally trained on.  ( 3 min )

We introduce a new automatic evaluation method for speaker similarity assessment, that is consistent with human perceptual scores. Modern neural text-to-speech models require a vast amount of clean training data, which is why many solutions switch from single speaker models to solutions trained on examples from many different speakers. Multi-speaker models bring new possibilities, such as a faster creation of new voices, but also a new problem - speaker leakage, where the speaker identity of a synthesized example might not match those of the target speaker. Currently, the only way to discover this issue is through costly perceptual evaluations. In this work, we propose an automatic method for assessment of speaker similarity. For that purpose, we extend the recent work on speaker verification systems and evaluate how different metrics and speaker embeddings models reflect Multiple Stimuli with Hidden Reference and Anchor (MUSHRA) scores. Our experiments show that we can train a model to predict speaker similarity MUSHRA scores from speaker embeddings with 0.96 accuracy and significant correlation up to 0.78 Pearson score at the utterance level.  ( 2 min )

In this paper, we address the Online Unsupervised Domain Adaptation (OUDA) problem and propose a novel multi-stage framework to solve real-world situations when the target data are unlabeled and arriving online sequentially in batches. To project the data from the source and the target domains to a common subspace and manipulate the projected data in real-time, our proposed framework institutes a novel method, called an Incremental Computation of Mean-Subspace (ICMS) technique, which computes an approximation of mean-target subspace on a Grassmann manifold and is proven to be a close approximate to the Karcher mean. Furthermore, the transformation matrix computed from the mean-target subspace is applied to the next target data in the recursive-feedback stage, aligning the target data closer to the source domain. The computation of transformation matrix and the prediction of next-target subspace leverage the performance of the recursive-feedback stage by considering the cumulative temporal dependency among the flow of the target subspace on the Grassmann manifold. The labels of the transformed target data are predicted by the pre-trained source classifier, then the classifier is updated by the transformed data and predicted labels. Extensive experiments on six datasets were conducted to investigate in depth the effect and contribution of each stage in our proposed framework and its performance over previous approaches in terms of classification accuracy and computational speed. In addition, the experiments on traditional manifold-based learning models and neural-network-based learning models demonstrated the applicability of our proposed framework for various types of learning models.  ( 3 min )

Large pretrained models can be privately fine-tuned to achieve performance approaching that of non-private models. A common theme in these results is the surprising observation that high-dimensional models can achieve favorable privacy-utility trade-offs. This seemingly contradicts known results on the model-size dependence of differentially private convex learning and raises the following research question: When does the performance of differentially private learning not degrade with increasing model size? We identify that the magnitudes of gradients projected onto subspaces is a key factor that determines performance. To precisely characterize this for private convex learning, we introduce a condition on the objective that we term restricted Lipschitz continuity and derive improved bounds for the excess empirical and population risks that are dimension-independent under additional conditions. We empirically show that in private fine-tuning of large language models, gradients evaluated near a local optimum are mostly controlled by a few principal components. This behavior is similar to conditions under which we obtain dimension-independent bounds in convex settings. Our theoretical and empirical results together provide a possible explanation for recent successes in large-scale private fine-tuning.  ( 2 min )

We study the impact of different pruning techniques on the representation learned by deep neural networks trained with contrastive loss functions. Our work finds that at high sparsity levels, contrastive learning results in a higher number of misclassified examples relative to models trained with traditional cross-entropy loss. To understand this pronounced difference, we use metrics such as the number of PIEs (Hooker et al., 2019), Q-Score (Kalibhat et al., 2022), and PD-Score (Baldock et al., 2021) to measure the impact of pruning on the learned representation quality. Our analysis suggests the schedule of the pruning method implementation matters. We find that the negative impact of sparsity on the quality of the learned representation is the highest when pruning is introduced early on in the training phase.  ( 2 min )

Non-intrusive load monitoring (NILM), which usually utilizes machine learning methods and is effective in disaggregating smart meter readings from the household-level into appliance-level consumption, can help analyze electricity consumption behaviours of users and enable practical smart energy and smart grid applications. Recent studies have proposed many novel NILM frameworks based on federated deep learning (FL). However, there lacks comprehensive research exploring the utility optimization schemes and the privacy-preserving schemes in different FL-based NILM application scenarios. In this paper, we make the first attempt to conduct FL-based NILM focusing on both the utility optimization and the privacy-preserving by developing a distributed and privacy-preserving NILM (DP2-NILM) framework and carrying out comparative experiments on practical NILM scenarios based on real-world smart meter datasets. Specifically, two alternative federated learning strategies are examined in the utility optimization schemes, i.e., the FedAvg and the FedProx. Moreover, different levels of privacy guarantees, i.e., the local differential privacy federated learning and the global differential privacy federated learning are provided in the DP2-NILM. Extensive comparison experiments are conducted on three real-world datasets to evaluate the proposed framework.  ( 2 min )

In this paper we provide a novel approach to the analysis of kinetic models for label switching, which are used for particle systems that can randomly switch between gradient flows in different energy landscapes. Besides problems in biology and physics, we also demonstrate that stochastic gradient descent, the most popular technique in machine learning, can be understood in this setting, when considering a time-continuous variant. Our analysis is focusing on the case of evolution in a collection of external potentials, for which we provide analytical and numerical results about the evolution as well as the stationary problem.  ( 2 min )

Graph Neural Networks (GNNs) are a class of deep learning-based methods for processing graph domain information. GNNs have recently become a widely used graph analysis method due to their superior ability to learn representations for complex graph data. However, due to privacy concerns and regulation restrictions, centralized GNNs can be difficult to apply to data-sensitive scenarios. Federated learning (FL) is an emerging technology developed for privacy-preserving settings when several parties need to train a shared global model collaboratively. Although several research works have applied FL to train GNNs (Federated GNNs), there is no research on their robustness to backdoor attacks. This paper bridges this gap by conducting two types of backdoor attacks in Federated GNNs: centralized backdoor attacks (CBA) and distributed backdoor attacks (DBA). Our experiments show that the DBA attack success rate is higher than CBA in almost all evaluated cases. For CBA, the attack success rate of all local triggers is similar to the global trigger even if the training set of the adversarial party is embedded with the global trigger. To further explore the properties of two backdoor attacks in Federated GNNs, we evaluate the attack performance for a different number of clients, trigger sizes, poisoning intensities, and trigger densities. Moreover, we explore the robustness of DBA and CBA against two state-of-the-art defenses. We find that both attacks are robust against the investigated defenses, necessitating the need to consider backdoor attacks in Federated GNNs as a novel threat that requires custom defenses.  ( 3 min )

Methods for learning from demonstration (LfD) have shown success in acquiring behavior policies by imitating a user. However, even for a single task, LfD may require numerous demonstrations. For versatile agents that must learn many tasks via demonstration, this process would substantially burden the user if each task were learned in isolation. To address this challenge, we introduce the novel problem of lifelong learning from demonstration, which allows the agent to continually build upon knowledge learned from previously demonstrated tasks to accelerate the learning of new tasks, reducing the amount of demonstrations required. As one solution to this problem, we propose the first lifelong learning approach to inverse reinforcement learning, which learns consecutive tasks via demonstration, continually transferring knowledge between tasks to improve performance.  ( 2 min )

Graph Neural Networks (GNNs) have achieved promising performance in various real-world applications. Building a powerful GNN model is not a trivial task, as it requires a large amount of training data, powerful computing resources, and human expertise in fine-tuning the model. What is more, with the development of adversarial attacks, e.g., model stealing attacks, GNNs raise challenges to model authentication. To avoid copyright infringement on GNNs, it is necessary to verify the ownership of the GNN models. In this paper, we present a watermarking framework for GNNs for both graph and node classification tasks. We 1) design two strategies to generate watermarked data for the graph classification task and one for the node classification task, 2) embed the watermark into the host model through training to obtain the watermarked GNN model, and 3) verify the ownership of the suspicious model in a black-box setting. The experiments show that our framework can verify the ownership of GNN models with a very high probability (around $95\%$) for both tasks. Finally, we experimentally show that our watermarking approach is robust against two model modifications and an input reformation defense against backdoor attacks.  ( 3 min )

Data imbalance is a common problem in the machine learning literature that can have a critical effect on the performance of a model. Various solutions exist - such as the ones that focus on resampling or data generation - but their impact on the convergence of gradient-based optimizers used in deep learning is not understood. We here elucidate the significant negative impact of data imbalance on learning, showing that the learning curves for minority and majority classes follow sub-optimal trajectories when training with a gradient-based optimizer. The reason is not only that the gradient signal neglects the minority classes, but also that the minority classes are subject to a larger directional noise, which slows their learning by an amount related to the imbalance ratio. To address this problem, we propose a new algorithmic solution, for which we provide a detailed analysis of its convergence behavior. We show both theoretically and empirically that this new algorithm exhibits a better behavior with more stable learning curves for each class, as well as a better generalization performance.  ( 2 min )

The field of deep learning has witnessed a remarkable shift towards extremely compute- and memory-intensive neural networks. These newer larger models have enabled researchers to advance state-of-the-art tools across a variety of fields. This phenomenon has spurred the development of algorithms for distributed training of neural networks over a larger number of hardware accelerators. In this paper, we discuss and compare current state-of-the-art frameworks for large scale distributed deep learning. First, we survey current practices in distributed learning and identify the different types of parallelism used. Then, we present empirical results comparing their performance on large image and language training tasks. Additionally, we address their statistical efficiency and memory consumption behavior. Based on our results, we discuss algorithmic and implementation portions of each framework which hinder performance.  ( 2 min )

Topological data analysis (TDA) studies the shape patterns of data. Persistent homology is a widely used method in TDA that summarizes homological features of data at multiple scales and stores them in persistence diagrams (PDs). In this paper, we propose a random persistence diagram generator (RPDG) method that generates a sequence of random PDs from the ones produced by the data. RPDG is underpinned by a model based on pairwise interacting point processes, and a reversible jump Markov chain Monte Carlo (RJ-MCMC) algorithm. A first example, which is based on a synthetic dataset, demonstrates the efficacy of RPDG and provides a comparison with another method for sampling PDs. A second example demonstrates the utility of RPDG to solve a materials science problem given a real dataset of small sample size.  ( 2 min )

In the recent years, we have witnessed a huge growth in the number of Internet of Things (IoT) and edge devices being used in our everyday activities. This demands the security of these devices from cyber attacks to be improved to protect its users. For years, Machine Learning (ML) techniques have been used to develop Network Intrusion Detection Systems (NIDS) with the aim of increasing their reliability/robustness. Among the earlier ML techniques DT performed well. In the recent years, Deep Learning (DL) techniques have been used in an attempt to build more reliable systems. In this paper, a Deep Learning enabled Long Short Term Memory (LSTM) Autoencoder and a 13-feature Deep Neural Network (DNN) models were developed which performed a lot better in terms of accuracy on UNSW-NB15 and Bot-IoT datsets. Hence we proposed LBDMIDS, where we developed NIDS models based on variants of LSTMs namely, stacked LSTM and bidirectional LSTM and validated their performance on the UNSW\_NB15 and BoT\-IoT datasets. This paper concludes that these variants in LBDMIDS outperform classic ML techniques and perform similarly to the DNN models that have been suggested in the past.  ( 2 min )

We derive information theoretic generalization bounds for supervised learning algorithms based on a new measure of leave-one-out conditional mutual information (loo-CMI). Contrary to other CMI bounds, which are black-box bounds that do not exploit the structure of the problem and may be hard to evaluate in practice, our loo-CMI bounds can be computed easily and can be interpreted in connection to other notions such as classical leave-one-out cross-validation, stability of the optimization algorithm, and the geometry of the loss-landscape. It applies both to the output of training algorithms as well as their predictions. We empirically validate the quality of the bound by evaluating its predicted generalization gap in scenarios for deep learning. In particular, our bounds are non-vacuous on large-scale image-classification tasks.  ( 2 min )

We consider the problem of detecting OoD(Out-of-Distribution) input data when using deep neural networks, and we propose a simple yet effective way to improve the robustness of several popular OoD detection methods against label shift. Our work is motivated by the observation that most existing OoD detection algorithms consider all training/test data as a whole, regardless of which class entry each input activates (inter-class differences). Through extensive experimentation, we have found that such practice leads to a detector whose performance is sensitive and vulnerable to label shift. To address this issue, we propose a class-wise thresholding scheme that can apply to most existing OoD detection algorithms and can maintain similar OoD detection performance even in the presence of label shift in the test distribution.  ( 2 min )

Despite the tremendous advances in machine learning (ML), training with imbalanced data still poses challenges in many real-world applications. Among a series of diverse techniques to solve this problem, sampling algorithms are regarded as an efficient solution. However, the problem is more fundamental, with many works emphasizing the importance of instance hardness. This issue refers to the significance of managing unsafe or potentially noisy instances that are more likely to be misclassified and serve as the root cause of poor classification performance. This paper introduces HardVis, a visual analytics system designed to handle instance hardness mainly in imbalanced classification scenarios. Our proposed system assists users in visually comparing different distributions of data types, selecting types of instances based on local characteristics that will later be affected by the active sampling method, and validating which suggestions from undersampling or oversampling techniques are beneficial for the ML model. Additionally, rather than uniformly undersampling/oversampling a specific class, we allow users to find and sample easy and difficult to classify training instances from all classes. Users can explore subsets of data from different perspectives to decide all those parameters, while HardVis keeps track of their steps and evaluates the model's predictive performance in a test set separately. The end result is a well-balanced data set that boosts the predictive power of the ML model. The efficacy and effectiveness of HardVis are demonstrated with a hypothetical usage scenario and a use case. Finally, we also look at how useful our system is based on feedback we received from ML experts.

Click-through rate (CTR) prediction is a fundamental technique in recommendation and advertising systems. Recent studies have proved that learning a unified model to serve multiple domains is effective to improve the overall performance. However, it is still challenging to improve generalization across domains under limited training data, and hard to deploy current solutions due to their computational complexity. In this paper, we propose a simple yet effective framework AdaSparse for multi-domain CTR prediction, which learns adaptively sparse structure for each domain, achieving better generalization across domains with lower computational cost. In AdaSparse, we introduce domain-aware neuron-level weighting factors to measure the importance of neurons, with that for each domain our model can prune redundant neurons to improve generalization. We further add flexible sparsity regularizations to control the sparsity ratio of learned structures. Offline and online experiments show that AdaSparse outperforms previous multi-domain CTR models significantly.

In many real-world scenarios, the utility of a user is derived from the single execution of a policy. In this case, to apply multi-objective reinforcement learning, the expected utility of the returns must be optimised. Various scenarios exist where a user's preferences over objectives (also known as the utility function) are unknown or difficult to specify. In such scenarios, a set of optimal policies must be learned. However, settings where the expected utility must be maximised have been largely overlooked by the multi-objective reinforcement learning community and, as a consequence, a set of optimal solutions has yet to be defined. In this paper we address this challenge by proposing first-order stochastic dominance as a criterion to build solution sets to maximise expected utility. We also propose a new dominance criterion, known as expected scalarised returns (ESR) dominance, that extends first-order stochastic dominance to allow a set of optimal policies to be learned in practice. We then define a new solution concept called the ESR set, which is a set of policies that are ESR dominant. Finally, we define a new multi-objective distributional tabular reinforcement learning (MOT-DRL) algorithm to learn the ESR set in a multi-objective multi-armed bandit setting.

The Observation--Hypothesis--Prediction--Experimentation loop paradigm for scientific research has been practiced by researchers for years towards scientific discoveries. However, with data explosion in both mega-scale and milli-scale scientific research, it has been sometimes very difficult to manually analyze the data and propose new hypotheses to drive the cycle for scientific discovery. In this paper, we discuss the role of Explainable AI in scientific discovery process by demonstrating an Explainable AI-based paradigm for science discovery. The key is to use Explainable AI to help derive data or model interpretations, hypotheses, as well as scientific discoveries or insights. We show how computational and data-intensive methodology -- together with experimental and theoretical methodology -- can be seamlessly integrated for scientific research. To demonstrate the AI-based science discovery process, and to pay our respect to some of the greatest minds in human history, we show how Kepler's laws of planetary motion and Newton's law of universal gravitation can be rediscovered by (Explainable) AI based on Tycho Brahe's astronomical observation data, whose works were leading the scientific revolution in the 16-17th century. This work also highlights the important role of Explainable AI (as compared to Blackbox AI) in science discovery to help humans prevent or better prepare for the possible technological singularity that may happen in the future, since science is not only about the know how, but also the know why.

We introduce Goldilocks Selection, a technique for faster model training which selects a sequence of training points that are "just right". We propose an information-theoretic acquisition function -- the reducible validation loss -- and compute it with a small proxy model -- GoldiProx -- to efficiently choose training points that maximize information about a validation set. We show that the "hard" (e.g. high loss) points usually selected in the optimization literature are typically noisy, while the "easy" (e.g. low noise) samples often prioritized for curriculum learning confer less information. Further, points with uncertain labels, typically targeted by active learning, tend to be less relevant to the task. In contrast, Goldilocks Selection chooses points that are "just right" and empirically outperforms the above approaches. Moreover, the selected sequence can transfer to other architectures; practitioners can share and reuse it without the need to recreate it.

We present FREDo, a few-shot document-level relation extraction (FSDLRE) benchmark. As opposed to existing benchmarks which are built on sentence-level relation extraction corpora, we argue that document-level corpora provide more realism, particularly regarding none-of-the-above (NOTA) distributions. Therefore, we propose a set of FSDLRE tasks and construct a benchmark based on two existing supervised learning data sets, DocRED and sciERC. We adapt the state-of-the-art sentence-level method MNAV to the document-level and develop it further for improved domain adaptation. We find FSDLRE to be a challenging setting with interesting new characteristics such as the ability to sample NOTA instances from the support set. The data, code, and trained models are available online (https://github.com/nicpopovic/FREDo).

Incorporating symmetries can lead to highly data-efficient and generalizable models by defining equivalence classes of data samples related by transformations. However, characterizing how transformations act on input data is often difficult, limiting the applicability of equivariant models. We propose learning symmetric embedding networks (SENs) that encode an input space (e.g. images), where we do not know the effect of transformations (e.g. rotations), to a feature space that transforms in a known manner under these operations. This network can be trained end-to-end with an equivariant task network to learn an explicitly symmetric representation. We validate this approach in the context of equivariant transition models with 3 distinct forms of symmetry. Our experiments demonstrate that SENs facilitate the application of equivariant networks to data with complex symmetry representations. Moreover, doing so can yield improvements in accuracy and generalization relative to both fully-equivariant and non-equivariant baselines.

Graph Drawing techniques have been developed in the last few years with the purpose of producing aesthetically pleasing node-link layouts. Recently, the employment of differentiable loss functions has paved the road to the massive usage of Gradient Descent and related optimization algorithms. In this paper, we propose a novel framework for the development of Graph Neural Drawers (GND), machines that rely on neural computation for constructing efficient and complex maps. GNDs are Graph Neural Networks (GNNs) whose learning process can be driven by any provided loss function, such as the ones commonly employed in Graph Drawing. Moreover, we prove that this mechanism can be guided by loss functions computed by means of Feedforward Neural Networks, on the basis of supervision hints that express beauty properties, like the minimization of crossing edges. In this context, we show that GNNs can nicely be enriched by positional features to deal also with unlabelled vertexes. We provide a proof-of-concept by constructing a loss function for the edge-crossing and provide quantitative and qualitative comparisons among different GNN models working under the proposed framework.

Many real world graphs contain time domain information. Temporal Graph Neural Networks capture temporal information as well as structural and contextual information in the generated dynamic node embeddings. Researchers have shown that these embeddings achieve state-of-the-art performance in many different tasks. In this work, we propose TGL, a unified framework for large-scale offline Temporal Graph Neural Network training where users can compose various Temporal Graph Neural Networks with simple configuration files. TGL comprises five main components, a temporal sampler, a mailbox, a node memory module, a memory updater, and a message passing engine. We design a Temporal-CSR data structure and a parallel sampler to efficiently sample temporal neighbors to formtraining mini-batches. We propose a novel random chunk scheduling technique that mitigates the problem of obsolete node memory when training with a large batch size. To address the limitations of current TGNNs only being evaluated on small-scale datasets, we introduce two large-scale real-world datasets with 0.2 and 1.3 billion temporal edges. We evaluate the performance of TGL on four small-scale datasets with a single GPU and the two large datasets with multiple GPUs for both link prediction and node classification tasks. We compare TGL with the open-sourced code of five methods and show that TGL achieves similar or better accuracy with an average of 13x speedup. Our temporal parallel sampler achieves an average of 173x speedup on a multi-core CPU compared with the baselines. On a 4-GPU machine, TGL can train one epoch of more than one billion temporal edges within 1-10 hours. To the best of our knowledge, this is the first work that proposes a general framework for large-scale Temporal Graph Neural Networks training on multiple GPUs.

Most evolutionary-oriented deep generative models do not explicitly consider the underlying evolutionary dynamics of biological sequences as it is performed within the Bayesian phylogenetic inference framework. In this study, we propose a method for a deep variational Bayesian generative model (EvoVGM) that jointly approximates the true posterior of local evolutionary parameters and generates sequence alignments. Moreover, it is instantiated and tuned for continuous-time Markov chain substitution models such as JC69, K80 and GTR. We train the model via a low-variance stochastic estimator and a gradient ascent algorithm. Here, we analyze the consistency and effectiveness of EvoVGM on synthetic sequence alignments simulated with several evolutionary scenarios and different sizes. Finally, we highlight the robustness of a fine-tuned EvoVGM model using a sequence alignment of gene S of coronaviruses.

In this paper, we propose GT-GDA, a distributed optimization method to solve saddle point problems of the form: $\min_{\mathbf{x}} \max_{\mathbf{y}} \{F(\mathbf{x},\mathbf{y}) :=G(\mathbf{x}) + \langle \mathbf{y}, \overline{P} \mathbf{x} \rangle - H(\mathbf{y})\}$, where the functions $G(\cdot)$, $H(\cdot)$, and the the coupling matrix $\overline{P}$ are distributed over a strongly connected network of nodes. GT-GDA is a first-order method that uses gradient tracking to eliminate the dissimilarity caused by heterogeneous data distribution among the nodes. In the most general form, GT-GDA includes a consensus over the local coupling matrices to achieve the optimal (unique) saddle point, however, at the expense of increased communication. To avoid this, we propose a more efficient variant GT-GDA-Lite that does not incur the additional communication and analyze its convergence in various scenarios. We show that GT-GDA converges linearly to the unique saddle point solution when $G(\cdot)$ is smooth and convex, $H(\cdot)$ is smooth and strongly convex, and the global coupling matrix $\overline{P}$ has full column rank. We further characterize the regime under which GT-GDA exhibits a network topology-independent convergence behavior. We next show the linear convergence of GT-GDA to an error around the unique saddle point, which goes to zero when the coupling cost ${\langle \mathbf y, \overline{P} \mathbf x \rangle}$ is common to all nodes, or when $G(\cdot)$ and $H(\cdot)$ are quadratic. Numerical experiments illustrate the convergence properties and importance of GT-GDA and GT-GDA-Lite for several applications.

Visual representation learning is ubiquitous in various real-world applications, including visual comprehension, video understanding, multi-modal analysis, human-computer interaction, and urban computing. Due to the emergence of huge amounts of multi-modal heterogeneous spatial/temporal/spatial-temporal data in big data era, the lack of interpretability, robustness, and out-of-distribution generalization are becoming the challenges of the existing visual models. The majority of the existing methods tend to fit the original data/variable distributions and ignore the essential causal relations behind the multi-modal knowledge, which lacks an unified guidance and analysis about why modern visual representation learning methods are easily collapse into data bias and have limited generalization and cognitive abilities. Inspired by the strong inference ability of human-level agents, recent years have therefore witnessed great effort in developing causal reasoning paradigms to realize robust representation and model learning with good cognitive ability. In this paper, we conduct a comprehensive review of existing causal reasoning methods for visual representation learning, covering fundamental theories, models, and datasets. The limitations of current methods and datasets are also discussed. Moreover, we propose some prospective challenges, opportunities, and future research directions for benchmarking causal reasoning algorithms in visual representation learning. This paper aims to provide a comprehensive overview of this emerging field, attract attention, encourage discussions, bring to the forefront the urgency of developing novel causal reasoning methods, publicly available benchmarks, and consensus-building standards for reliable visual representation learning and related real-world applications more efficiently.

In machine learning (ML) workflows, determining the invariance qualities of an ML model is a common testing procedure. Traditionally, invariance qualities are evaluated using simple formula-based scores, e.g., accuracy. In this paper, we show that testing the invariance qualities of ML models may result in complex visual patterns that cannot be classified using simple formulas. In order to test ML models by analyzing such visual patterns automatically using other ML models, we propose a systematic framework that is applicable to a variety of invariance qualities. We demonstrate the effectiveness and feasibility of the framework by developing ML4ML models (assessors) for determining rotation-, brightness-, and size-variances of a collection of neural networks. Our testing results show that the trained ML4ML assessors can perform such analytical tasks with sufficient accuracy.

Machine learning is rapidly becoming a core technology for scientific computing, with numerous opportunities to advance the field of computational fluid dynamics. In this Perspective, we highlight some of the areas of highest potential impact, including to accelerate direct numerical simulations, to improve turbulence closure modeling, and to develop enhanced reduced-order models. We also discuss emerging areas of machine learning that are promising for computational fluid dynamics, as well as some potential limitations that should be taken into account.

Model compression is an essential technique for deploying deep neural networks (DNNs) on power and memory-constrained resources. However, existing model-compression methods often rely on human expertise and focus on parameters' local importance, ignoring the rich topology information within DNNs. In this paper, we propose a novel multi-stage graph embedding technique based on graph neural networks (GNNs) to identify DNN topologies and use reinforcement learning (RL) to find a suitable compression policy. We performed resource-constrained (i.e., FLOPs) channel pruning and compared our approach with state-of-the-art model compression methods. We evaluated our method on various models from typical to mobile-friendly networks, such as ResNet family, VGG-16, MobileNet-v1/v2, and ShuffleNet. Results show that our method can achieve higher compression ratios with a minimal fine-tuning cost yet yields outstanding and competitive performance.

A determinantal point process (DPP) is an elegant model that assigns a probability to every subset of a collection of $n$ items. While conventionally a DPP is parameterized by a symmetric kernel matrix, removing this symmetry constraint, resulting in nonsymmetric DPPs (NDPPs), leads to significant improvements in modeling power and predictive performance. Recent work has studied an approximate Markov chain Monte Carlo (MCMC) sampling algorithm for NDPPs restricted to size-$k$ subsets (called $k$-NDPPs). However, the runtime of this approach is quadratic in $n$, making it infeasible for large-scale settings. In this work, we develop a scalable MCMC sampling algorithm for $k$-NDPPs with low-rank kernels, thus enabling runtime that is sublinear in $n$. Our method is based on a state-of-the-art NDPP rejection sampling algorithm, which we enhance with a novel approach for efficiently constructing the proposal distribution. Furthermore, we extend our scalable $k$-NDPP sampling algorithm to NDPPs without size constraints. Our resulting sampling method has polynomial time complexity in the rank of the kernel, while the existing approach has runtime that is exponential in the rank. With both a theoretical analysis and experiments on real-world datasets, we verify that our scalable approximate sampling algorithms are orders of magnitude faster than existing sampling approaches for $k$-NDPPs and NDPPs.

We discuss topological aspects of cluster analysis and show that inferring the topological structure of a dataset before clustering it can considerably enhance cluster detection: theoretical arguments and empirical evidence show that clustering embedding vectors, representing the structure of a data manifold instead of the observed feature vectors themselves, is highly beneficial. To demonstrate, we combine manifold learning method UMAP for inferring the topological structure with density-based clustering method DBSCAN. Synthetic and real data results show that this both simplifies and improves clustering in a diverse set of low- and high-dimensional problems including clusters of varying density and/or entangled shapes. Our approach simplifies clustering because topological pre-processing consistently reduces parameter sensitivity of DBSCAN. Clustering the resulting embeddings with DBSCAN can then even outperform complex methods such as SPECTACL and ClusterGAN. Finally, our investigation suggests that the crucial issue in clustering does not appear to be the nominal dimension of the data or how many irrelevant features it contains, but rather how \textit{separable} the clusters are in the ambient observation space they are embedded in, which is usually the (high-dimensional) Euclidean space defined by the features of the data. Our approach is successful because we perform the cluster analysis after projecting the data into a more suitable space that is optimized for separability, in some sense.

The latest advances of statistical physics have shown remarkable performance of machine learning in identifying phase transitions. In this paper, we apply domain adversarial neural network (DANN) based on transfer learning to studying non-equilibrium and equilibrium phase transition models, which are percolation model and directed percolation (DP) model, respectively. With the DANN, only a small fraction of input configurations (2d images) needs to be labeled, which is automatically chosen, in order to capture the critical point. To learn the DP model, the method is refined by an iterative procedure in determining the critical point, which is a prerequisite for the data collapse in calculating the critical exponent $\nu_{\perp}$. We then apply the DANN to a two-dimensional site percolation with configurations filtered to include only the largest cluster which may contain the information related to the order parameter. The DANN learning of both models yields reliable results which are comparable to the ones from Monte Carlo simulations. Our study also shows that the DANN can achieve quite high accuracy at much lower cost, compared to the supervised learning.

We present CRISP (COVID-19 Risk Score Prediction), a probabilistic graphical model for COVID-19 infection spread through a population based on the SEIR model where we assume access to (1) mutual contacts between pairs of individuals across time across various channels (e.g., Bluetooth contact traces), as well as (2) test outcomes at given times for infection, exposure and immunity tests. Our micro-level model keeps track of the infection state for each individual at every point in time, ranging from susceptible, exposed, infectious to recovered. We develop both a Monte Carlo EM as well as a message passing algorithm to infer contact-channel specific infection transmission probabilities. Our Monte Carlo algorithm uses Gibbs sampling to draw samples of the latent infection status of each individual over the entire time period of analysis, given the latent infection status of all contacts and test outcome data. Experimental results with simulated data demonstrate our CRISP model can be parametrized by the reproduction factor $R_0$ and exhibits population-level infectiousness and recovery time series similar to those of the classical SEIR model. However, due to the individual contact data, this model allows fine grained control and inference for a wide range of COVID-19 mitigation and suppression policy measures. Moreover, the block-Gibbs sampling algorithm is able to support efficient testing in a test-trace-isolate approach to contain COVID-19 infection spread. To the best of our knowledge, this is the first model with efficient inference for COVID-19 infection spread based on individual-level contact data; most epidemic models are macro-level models that reason over entire populations. The implementation of CRISP is available in Python and C++ at https://github.com/zalandoresearch/CRISP.  ( 3 min )

Causal effect estimation is important for numerous tasks in the natural and social sciences. However, identifying effects is impossible from observational data without making strong, often untestable assumptions. We consider algorithms for the partial identification problem, bounding treatment effects from multivariate, continuous treatments over multiple possible causal models when unmeasured confounding makes identification impossible. We consider a framework where observable evidence is matched to the implications of constraints encoded in a causal model by norm-based criteria. This generalizes classical approaches based purely on generative models. Casting causal effects as objective functions in a constrained optimization problem, we combine flexible learning algorithms with Monte Carlo methods to implement a family of solutions under the name of stochastic causal programming. In particular, we present ways by which such constrained optimization problems can be parameterized without likelihood functions for the causal or the observed data model, reducing the computational and statistical complexity of the task.

In this work we demonstrate how both the Stochastic and Risk Sensitive Optimal Control problem can be treated by means of the Expectation-Maximisation algorithm. We show how such a treatment materialises into two separate iterative programs that each generate a unique but closely related sequence of density functions. We motivate to interpret these density functions as beliefs, ergo as probabilistic proxies for the deterministic optimal policy. More formally two fixed point iteration schemes are derived with the stationary point coinciding with the deterministic optimal policies on behalf of the proven convergence of Expectation-Maximisation methods. We are inclined to point out our results are intimately related with the paradigm of Control as Inference. Control as inference here refers to a collection of approaches which aim is also to recast optimal control as an instance of probabilistic inference. Although said paradigm already resulted in the development of several powerful Reinforcement Learning algorithms, the fundamental problem statement usually is introduced by teleological arguments. We argue that the present results demonstrate that earlier established Control as Inference frameworks in fact isolate a single step from either of the proposed iterative programs. In any case the present treatment provides them with a deontological argument of validity. By exposing the underlying technical mechanism we aim to contribute to the general acceptance of Control as Inference as a framework superseding the present Optimal Control paradigm. In order to motivate the general relevance of the presented treatment we further discuss parallels with Path Integral Control and other areas of research before sketching the outlines of future algorithmic development.

Applications of machine learning in healthcare often require working with time-to-event prediction tasks including prognostication of an adverse event, re-hospitalization or death. Such outcomes are typically subject to censoring due to loss of follow up. Standard machine learning methods cannot be applied in a straightforward manner to datasets with censored outcomes. In this paper, we present auton-survival, an open-source repository of tools to streamline working with censored time-to-event or survival data. auton-survival includes tools for survival regression, adjustment in the presence of domain shift, counterfactual estimation, phenotyping for risk stratification, evaluation, as well as estimation of treatment effects. Through real world case studies employing a large subset of the SEER oncology incidence data, we demonstrate the ability of auton-survival to rapidly support data scientists in answering complex health and epidemiological questions.

Despite their ubiquity throughout science and engineering, only a handful of partial differential equations (PDEs) have analytical, or closed-form solutions. This motivates a vast amount of classical work on numerical simulation of PDEs and more recently, a whirlwind of research into data-driven techniques leveraging machine learning (ML). A recent line of work indicates that a hybrid of classical numerical techniques with machine learning can offer significant improvements over either approach alone. In this work, we show that the choice of the numerical scheme is crucial when incorporating physics-based priors. We build upon Fourier-based spectral methods, which are considerably more efficient than other numerical schemes for simulating PDEs with smooth and periodic solutions. Specifically, we develop ML-augmented spectral solvers for three model PDEs of fluid dynamics, which improve upon the accuracy of standard spectral solvers at the same resolution. We also demonstrate a handful of key design principles for combining machine learning and numerical methods for solving PDEs.

Methods that extract policy primitives from offline demonstrations using deep generative models have shown promise at accelerating reinforcement learning(RL) for new tasks. Intuitively, these methods should also help to trainsafeRLagents because they enforce useful skills. However, we identify these techniques are not well equipped for safe policy learning because they ignore negative experiences(e.g., unsafe or unsuccessful), focusing only on positive experiences, which harms their ability to generalize to new tasks safely. Rather, we model the latentsafetycontextusing principled contrastive training on an offline dataset of demonstrations from many tasks, including both negative and positive experiences. Using this late variable, our RL framework, SAFEty skill pRiors (SAFER) extracts task-specific safe primitive skills to safely and successfully generalize to new tasks. In the inference stage, policies trained with SAFER learn to compose safe skills into successful policies. We theoretically characterize why SAFER can enforce safe policy learning and demonstrate its effectiveness on several complex safety-critical robotic grasping tasks inspired by the game Operation, in which SAFERoutperforms state-of-the-art primitive learning methods in success and safety.

The finance industry has adopted machine learning (ML) as a form of quantitative research to support better investment decisions, yet there are several challenges often overlooked in practice. (1) ML code tends to be unstructured and ad hoc, which hinders cooperation with others. (2) Resource requirements and dependencies vary depending on which algorithm is used, so a flexible and scalable system is needed. (3) It is difficult for domain experts in traditional finance to apply their experience and knowledge in ML-based strategies unless they acquire expertise in recent technologies. This paper presents Shai-am, an ML platform integrated with our own Python framework. The platform leverages existing modern open-source technologies, managing containerized pipelines for ML-based strategies with unified interfaces to solve the aforementioned issues. Each strategy implements the interface defined in the core framework. The framework is designed to enhance reusability and readability, facilitating collaborative work in quantitative research. Shai-am aims to be a pure AI asset manager for solving various tasks in financial markets.  ( 2 min )

Learning task-oriented dialog policies via reinforcement learning typically requires large amounts of interaction with users, which in practice renders such methods unusable for real-world applications. In order to reduce the data requirements, we propose to leverage data from across different dialog domains, thereby reducing the amount of data required from each given domain. In particular, we propose to learn domain-agnostic action embeddings, which capture general-purpose structure that informs the system how to act given the current dialog context, and are then specialized to a specific domain. We show how this approach is capable of learning with significantly less interaction with users, with a reduction of 35% in the number of dialogs required to learn, and to a higher level of proficiency than training separate policies for each domain on a set of simulated domains.

For efficient malware removal, determination of malware threat levels, and damage estimation, malware family classification plays a critical role. In this paper, we extract features from malware executable files and represent them as images using various approaches. We then focus on Generative Adversarial Networks (GAN) for multiclass classification and compare our GAN results to other popular machine learning techniques, including Support Vector Machine (SVM), XGBoost, and Restricted Boltzmann Machines (RBM). We find that the AC-GAN discriminator is generally competitive with other machine learning techniques. We also evaluate the utility of the GAN generative model for adversarial attacks on image-based malware detection. While AC-GAN generated images are visually impressive, we find that they are easily distinguished from real malware images using any of several learning techniques. This result indicates that our GAN generated images would be of little value in adversarial attacks.  ( 2 min )

The emerging class of instance-optimized systems has shown potential to achieve high performance by specializing to a specific data and query workloads. Particularly, Machine Learning (ML) techniques have been applied successfully to build various instance-optimized components (e.g., learned indexes). This paper investigates to leverage ML techniques to enhance the performance of spatial indexes, particularly the R-tree, for a given data and query workloads. As the areas covered by the R-tree index nodes overlap in space, upon searching for a specific point in space, multiple paths from root to leaf may potentially be explored. In the worst case, the entire R-tree could be searched. In this paper, we define and use the overlap ratio to quantify the degree of extraneous leaf node accesses required by a range query. The goal is to enhance the query performance of a traditional R-tree for high-overlap range queries as they tend to incur long running-times. We introduce a new AI-tree that transforms the search operation of an R-tree into a multi-label classification task to exclude the extraneous leaf node accesses. Then, we augment a traditional R-tree to the AI-tree to form a hybrid "AI+R"-tree. The "AI+R"-tree can automatically differentiate between the high- and low-overlap queries using a learned model. Thus, the "AI+R"-tree processes high-overlap queries using the AI-tree, and the low-overlap queries using the R-tree. Experiments on real datasets demonstrate that the "AI+R"-tree can enhance the query performance over a traditional R-tree by up to 500%.  ( 3 min )

We consider $K$-armed stochastic bandits and consider cumulative regret bounds up to time $T$. We are interested in strategies achieving simultaneously a distribution-free regret bound of optimal order $\sqrt{KT}$ and a distribution-dependent regret that is asymptotically optimal, that is, matching the $\kappa\ln T$ lower bound by Lai and Robbins (1985) and Burnetas and Katehakis (1996), where $\kappa$ is the optimal problem-dependent constant. This constant $\kappa$ depends on the model $\mathcal{D}$ considered (the family of possible distributions over the arms). M\'enard and Garivier (2017) provided strategies achieving such a bi-optimality in the parametric case of models given by one-dimensional exponential families, while Lattimore (2016, 2018) did so for the family of (sub)Gaussian distributions with variance less than $1$. We extend this result to the non-parametric case of all distributions over $[0,1]$. We do so by combining the MOSS strategy by Audibert and Bubeck (2009), which enjoys a distribution-free regret bound of optimal order $\sqrt{KT}$, and the KL-UCB strategy by Capp\'e et al. (2013), for which we provide in passing the first analysis of an optimal distribution-dependent $\kappa\ln T$ regret bound in the model of all distributions over $[0,1]$. We were able to obtain this non-parametric bi-optimality result while working hard to streamline the proofs (of previously known regret bounds and thus of the new analyses carried out); a second merit of the present contribution is therefore to provide a review of proofs of classical regret bounds for index-based strategies for $K$-armed stochastic bandits.

Over the past decades, the incidence of thyroid cancer has been increasing globally. Accurate and early diagnosis allows timely treatment and helps to avoid over-diagnosis. Clinically, a nodule is commonly evaluated from both transverse and longitudinal views using thyroid ultrasound. However, the appearance of the thyroid gland and lesions can vary dramatically across individuals. Identifying key diagnostic information from both views requires specialized expertise. Furthermore, finding an optimal way to integrate multi-view information also relies on the experience of clinicians and adds further difficulty to accurate diagnosis. To address these, we propose a personalized diagnostic tool that can customize its decision-making process for different patients. It consists of a multi-view classification module for feature extraction and a personalized weighting allocation network that generates optimal weighting for different views. It is also equipped with a self-supervised view-aware contrastive loss to further improve the model robustness towards different patient groups. Experimental results show that the proposed framework can better utilize multi-view information and outperform the competing methods.  ( 2 min )

Considering high-temperature heating, the equations of transient heat conduction model require an adaptation, i.e. the dependence of thermophysical parameters of the model on the temperature is to be identified for each specific material to be heated. This problem is most often solved by approximation of the tabular data on the measurements of the required parameters, which can be found in the literature, by means of regression equations. But, for example, considering the steel heating process, this approach is difficult to be implemented due to the lack of tabular discrete measurements for many grades of steel, such as alloyed ones. In this paper, the new approach is proposed, which is based on a solution of a related variational problem. Its main idea is to substitute the adaptation process in the classical sense (i.e., to find the dependencies of thermophysical parameters on temperature) with 'supervised learning' of a mesh model on the basis of the technological data received from the plant. The equations to adjust the parameters of the transient heat conduction model, which are related to the thermophysical coefficients, have been derived. A numerical experiment is conducted for steel of a particular group of grades, for which enough both technological as well as tabular data are available. As a result, the 'trained' mesh model, which has not received explicitly any information about the physical and chemical properties of the heated substance, demonstrated an average error of 18.820 C, which is quite close to the average error of the model adapted classically on the basis of the tabular data (18.10 C).  ( 3 min )

This paper demonstrates spherical convolutional neural networks (S-CNN) offer distinct advantages over conventional fully-connected networks (FCN) at estimating scalar parameters of tissue microstructure from diffusion MRI (dMRI). Such microstructure parameters are valuable for identifying pathology and quantifying its extent. However, current clinical practice commonly acquires dMRI data consisting of only 6 diffusion weighted images (DWIs), limiting the accuracy and precision of estimated microstructure indices. Machine learning (ML) has been proposed to address this challenge. However, existing ML-based methods are not robust to differing dMRI gradient sampling schemes, nor are they rotation equivariant. Lack of robustness to sampling schemes requires a new network to be trained for each scheme, complicating the analysis of data from multiple sources. A possible consequence of the lack of rotational equivariance is that the training dataset must contain a diverse range of microstucture orientations. Here, we show spherical CNNs represent a compelling alternative that is robust to new sampling schemes as well as offering rotational equivariance. We show the latter can be leveraged to decrease the number of training datapoints required.  ( 2 min )

In this paper, a shallow Ritz-type neural network for solving elliptic equations with delta function singular sources on an interface is developed. There are three novel features in the present work; namely, (i) the delta function singularity is naturally removed, (ii) level set function is introduced as a feature input, (iii) it is completely shallow, comprising only one hidden layer. We first introduce the energy functional of the problem and then transform the contribution of singular sources to a regular surface integral along the interface. In such a way, the delta function singularity can be naturally removed without introducing a discrete one that is commonly used in traditional regularization methods, such as the well-known immersed boundary method. The original problem is then reformulated as a minimization problem. We propose a shallow Ritz-type neural network with one hidden layer to approximate the global minimizer of the energy functional. As a result, the network is trained by minimizing the loss function that is a discrete version of the energy. In addition, we include the level set function of the interface as a feature input of the network and find that it significantly improves the training efficiency and accuracy. We perform a series of numerical tests to show the accuracy of the present method and its capability for problems in irregular domains and higher dimensions.

Controllable generative sequence models with the capability to extract and replicate the style of specific examples enable many applications, including narrating audiobooks in different voices, auto-completing and auto-correcting written handwriting, and generating missing training samples for downstream recognition tasks. However, under an unsupervised-style setting, typical training algorithms for controllable sequence generative models suffer from the training-inference mismatch, where the same sample is used as content and style input during training but unpaired samples are given during inference. In this paper, we tackle the training-inference mismatch encountered during unsupervised learning of controllable generative sequence models. The proposed method is simple yet effective, where we use a style transformation module to transfer target style information into an unrelated style input. This method enables training using unpaired content and style samples and thereby mitigate the training-inference mismatch. We apply style equalization to text-to-speech and text-to-handwriting synthesis on three datasets. We conduct thorough evaluation, including both quantitative and qualitative user studies. Our results show that by mitigating the training-inference mismatch with the proposed style equalization, we achieve style replication scores comparable to real data in our user studies.  ( 3 min )

Rapid development of renewable energy sources, particularly solar photovoltaics (PV), is critical to mitigate climate change. As a result, India has set ambitious goals to install 500 gigawatts of solar energy capacity by 2030. Given the large footprint projected to meet renewables energy targets, the potential for land use conflicts over environmental values is high. To expedite development of solar energy, land use planners will need access to up-to-date and accurate geo-spatial information of PV infrastructure. In this work, we developed a spatially explicit machine learning model to map utility-scale solar projects across India using freely available satellite imagery with a mean accuracy of 92%. Our model predictions were validated by human experts to obtain a dataset of 1363 solar PV farms. Using this dataset, we measure the solar footprint across India and quantified the degree of landcover modification associated with the development of PV infrastructure. Our analysis indicates that over 74% of solar development In India was built on landcover types that have natural ecosystem preservation, or agricultural value.

Speech dereverberation is often an important requirement in robust speech processing tasks. Supervised deep learning (DL) models give state-of-the-art performance for single-channel speech dereverberation. Temporal convolutional networks (TCNs) are commonly used for sequence modelling in speech enhancement tasks. A feature of TCNs is that they have a receptive field (RF) dependent on the specific model configuration which determines the number of input frames that can be observed to produce an individual output frame. It has been shown that TCNs are capable of performing dereverberation of simulated speech data, however a thorough analysis, especially with focus on the RF is yet lacking in the literature. This paper analyses dereverberation performance depending on the model size and the RF of TCNs. Experiments using the WHAMR corpus which is extended to include room impulse responses (RIRs) with larger T60 values demonstrate that a larger RF can have significant improvement in performance when training smaller TCN models. It is also demonstrated that TCNs benefit from a wider RF when dereverberating RIRs with larger RT60 values.

Masked autoencoding has become a successful pre-training paradigm for Transformer models for text, images, and recently, point clouds. Raw automotive datasets are a suitable candidate for self-supervised pre-training as they generally are cheap to collect compared to annotations for tasks like 3D object detection (OD). However, development of masked autoencoders for point clouds has focused solely on synthetic and indoor data. Consequently, existing methods have tailored their representations and models toward point clouds which are small, dense and have homogeneous point density. In this work, we study masked autoencoding for point clouds in an automotive setting, which are sparse and for which the point density can vary drastically among objects in the same scene. To this end, we propose Voxel-MAE, a simple masked autoencoding pre-training scheme designed for voxel representations. We pre-train the backbone of a Transformer-based 3D object detector to reconstruct masked voxels and to distinguish between empty and non-empty voxels. Our method improves the 3D OD performance by 1.75 mAP points and 1.05 NDS on the challenging nuScenes dataset. Compared to existing self-supervised methods for automotive data, Voxel-MAE displays up to $2\times$ performance increase. Further, we show that by pre-training with Voxel-MAE, we require only 40% of the annotated data to outperform a randomly initialized equivalent. Code will be released.  ( 3 min )

Non-cooperative and cooperative games with a very large number of players have many applications but remain generally intractable when the number of players increases. Introduced by Lasry and Lions, and Huang, Caines and Malham\'e, Mean Field Games (MFGs) rely on a mean-field approximation to allow the number of players to grow to infinity. Traditional methods for solving these games generally rely on solving partial or stochastic differential equations with a full knowledge of the model. Recently, Reinforcement Learning (RL) has appeared promising to solve complex problems. By combining MFGs and RL, we hope to solve games at a very large scale both in terms of population size and environment complexity. In this survey, we review the quickly growing recent literature on RL methods to learn Nash equilibria in MFGs. We first identify the most common settings (static, stationary, and evolutive). We then present a general framework for classical iterative methods (based on best-response computation or policy evaluation) to solve MFGs in an exact way. Building on these algorithms and the connection with Markov Decision Processes, we explain how RL can be used to learn MFG solutions in a model-free way. Last, we present numerical illustrations on a benchmark problem, and conclude with some perspectives.

We introduce Habitat 2.0 (H2.0), a simulation platform for training virtual robots in interactive 3D environments and complex physics-enabled scenarios. We make comprehensive contributions to all levels of the embodied AI stack - data, simulation, and benchmark tasks. Specifically, we present: (i) ReplicaCAD: an artist-authored, annotated, reconfigurable 3D dataset of apartments (matching real spaces) with articulated objects (e.g. cabinets and drawers that can open/close); (ii) H2.0: a high-performance physics-enabled 3D simulator with speeds exceeding 25,000 simulation steps per second (850x real-time) on an 8-GPU node, representing 100x speed-ups over prior work; and, (iii) Home Assistant Benchmark (HAB): a suite of common tasks for assistive robots (tidy the house, prepare groceries, set the table) that test a range of mobile manipulation capabilities. These large-scale engineering contributions allow us to systematically compare deep reinforcement learning (RL) at scale and classical sense-plan-act (SPA) pipelines in long-horizon structured tasks, with an emphasis on generalization to new objects, receptacles, and layouts. We find that (1) flat RL policies struggle on HAB compared to hierarchical ones; (2) a hierarchy with independent skills suffers from 'hand-off problems', and (3) SPA pipelines are more brittle than RL policies.

We consider a model of robust learning in an adversarial environment. The learner gets uncorrupted training data with access to possible corruptions that may be affected by the adversary during testing. The learner's goal is to build a robust classifier, which will be tested on future adversarial examples. The adversary is limited to $k$ possible corruptions for each input. We model the learner-adversary interaction as a zero-sum game. This model is closely related to the adversarial examples model of Schmidt et al. (2018); Madry et al. (2017). Our main results consist of generalization bounds for the binary and multiclass classification, as well as the real-valued case (regression). For the binary classification setting, we both tighten the generalization bound of Feige et al. (2015), and are also able to handle infinite hypothesis classes. The sample complexity is improved from $O(\frac{1}{\epsilon^4}\log(\frac{|H|}{\delta}))$ to $O\big(\frac{1}{\epsilon^2}(kVC(H)\log^{\frac{3}{2}+\alpha}(kVC(H))+\log(\frac{1}{\delta})\big)$ for any $\alpha > 0$. Additionally, we extend the algorithm and generalization bound from the binary to the multiclass and real-valued cases. Along the way, we obtain results on fat-shattering dimension and Rademacher complexity of $k$-fold maxima over function classes; these may be of independent interest. For binary classification, the algorithm of Feige et al. (2015) uses a regret minimization algorithm and an ERM oracle as a black box; we adapt it for the multiclass and regression settings. The algorithm provides us with near-optimal policies for the players on a given training sample.

Speech intelligibility and quality assessment models are essential tools for researchers to evaluate and improve speech processing models. However, only a few studies have investigated multi-task models for intelligibility and quality assessment due to the limitations of available data. In this study, we released TMHINT-QI, the first Chinese speech dataset that records the quality and intelligibility scores of clean, noisy, and enhanced utterances. Then, we propose InQSS, a non-intrusive multi-task learning framework for intelligibility and quality assessment. We evaluated the InQSS on both the training-from-scratch and the pretrained models. The experimental results confirm the effectiveness of the InQSS framework. In addition, the resulting model can predict not only the intelligibility scores but also the quality scores of a speech signal.

Competitive online games use rating systems for matchmaking; progression-based algorithms that estimate the skill level of players with interpretable ratings in terms of the outcome of the games they played. However, the overall experience of players is shaped by factors beyond the sole outcome of their games. In this paper, we engineer several features from in-game statistics to model players and create ratings that accurately represent their behavior and true performance level. We then compare the estimating power of our behavioral ratings against ratings created with three mainstream rating systems by predicting rank of players in four popular game modes from the competitive shooter genre. Our results show that the behavioral ratings present more accurate performance estimations while maintaining the interpretability of the created representations. Considering different aspects of the playing behavior of players and using behavioral ratings for matchmaking can lead to match-ups that are more aligned with players' goals and interests, consequently resulting in a more enjoyable gaming experience.

Due to the superior performance of Graph Neural Networks (GNNs) in various domains, there is an increasing interest in the GNN explanation problem "\emph{which fraction of the input graph is the most crucial to decide the model's decision?}" Existing explanation methods focus on the supervised settings, \eg, node classification and graph classification, while the explanation for unsupervised graph-level representation learning is still unexplored. The opaqueness of the graph representations may lead to unexpected risks when deployed for high-stake decision-making scenarios. In this paper, we advance the Information Bottleneck principle (IB) to tackle the proposed explanation problem for unsupervised graph representations, which leads to a novel principle, \textit{Unsupervised Subgraph Information Bottleneck} (USIB). We also theoretically analyze the connection between graph representations and explanatory subgraphs on the label space, which reveals that the expressiveness and robustness of representations benefit the fidelity of explanatory subgraphs. Experimental results on both synthetic and real-world datasets demonstrate the superiority of our developed explainer and the validity of our theoretical analysis.  ( 2 min )

We introduce the problem of robust subgroup discovery, i.e., finding a set of interpretable descriptions of subsets that 1) stand out with respect to one or more target attributes, 2) are statistically robust, and 3) non-redundant. Many attempts have been made to mine either locally robust subgroups or to tackle the pattern explosion, but we are the first to address both challenges at the same time from a global modelling perspective. First, we formulate the broad model class of subgroup lists, i.e., ordered sets of subgroups, for univariate and multivariate targets that can consist of nominal or numeric variables, including traditional top-1 subgroup discovery in its definition. This novel model class allows us to formalise the problem of optimal robust subgroup discovery using the Minimum Description Length (MDL) principle, where we resort to optimal Normalised Maximum Likelihood and Bayesian encodings for nominal and numeric targets, respectively. Second, finding optimal subgroup lists is NP-hard. Therefore, we propose SSD++, a greedy heuristic that finds good subgroup lists and guarantees that the most significant subgroup found according to the MDL criterion is added in each iteration. In fact, the greedy gain is shown to be equivalent to a Bayesian one-sample proportion, multinomial, or t-test between the subgroup and dataset marginal target distributions plus a multiple hypothesis testing penalty. Furthermore, we empirically show on 54 datasets that SSD++ outperforms previous subgroup discovery methods in terms of quality, generalisation on unseen data, and subgroup list size.

This paper studies the robustness of data valuation to noisy model performance scores. Particularly, we find that the inherent randomness of the widely used stochastic gradient descent can cause existing data value notions (e.g., the Shapley value and the Leave-one-out error) to produce inconsistent data value rankings across different runs. To address this challenge, we first pose a formal framework within which one can measure the robustness of a data value notion. We show that the Banzhaf value, a value notion originated from cooperative game theory literature, achieves the maximal robustness among all semivalues -- a class of value notions that satisfy crucial properties entailed by ML applications. We propose an algorithm to efficiently estimate the Banzhaf value based on the Maximum Sample Reuse (MSR) principle. We derive the lower bound sample complexity for Banzhaf value approximation, and we show that our MSR algorithm's sample complexity nearly matches the lower bound. Our evaluation demonstrates that the Banzhaf value outperforms the existing semivalue-based data value notions on several downstream ML tasks such as learning with weighted samples and noisy label detection. Overall, our study suggests that when the underlying ML algorithm is stochastic, the Banzhaf value is a promising alternative to the semivalue-based data value schemes given its computational advantage and ability to robustly differentiate data quality.

Neural networks are ubiquitous in applied machine learning for education. Their pervasive success in predictive performance comes alongside a severe weakness, the lack of explainability of their decisions, especially relevant in human-centric fields. We implement five state-of-the-art methodologies for explaining black-box machine learning models (LIME, PermutationSHAP, KernelSHAP, DiCE, CEM) and examine the strengths of each approach on the downstream task of student performance prediction for five massive open online courses. Our experiments demonstrate that the families of explainers do not agree with each other on feature importance for the same Bidirectional LSTM models with the same representative set of students. We use Principal Component Analysis, Jensen-Shannon distance, and Spearman's rank-order correlation to quantitatively cross-examine explanations across methods and courses. Furthermore, we validate explainer performance across curriculum-based prerequisite relationships. Our results come to the concerning conclusion that the choice of explainer is an important decision and is in fact paramount to the interpretation of the predictive results, even more so than the course the model is trained on. Source code and models are released at this http URL

We propose a novel machine learning method for sampling from the high-dimensional probability distributions of Lattice Quantum Field Theories. Instead of the deep architectures used so far for this task, our proposal is based on a single neural ODE layer and incorporates the full symmetries of the problem. We test our model on the $\phi^4$ theory, showing that it systematically outperforms previously proposed flow-based methods in sampling efficiency, and the improvement is especially pronounced for larger lattices. Compared to the previous baseline model, we improve a key metric, the effective sample size, from 1% to 91% on a lattice of size $32\times 32$. We also demonstrate that our model can successfully learn a continuous family of theories at once, and the results of learning can be transferred to larger lattices. Such generalization capacities further accentuate the potential advantages of machine learning methods compared to traditional MCMC-based methods.

Vertical federated learning (VFL) is attracting much attention because it enables cross-silo data cooperation in a privacy-preserving manner. While most research works in VFL focus on linear and tree models, deep models (e.g., neural networks) are not well studied in VFL. In this paper, we focus on SplitNN, a well-known neural network framework in VFL, and identify a trade-off between data security and model performance in SplitNN. Briefly, SplitNN trains the model by exchanging gradients and transformed data. On the one hand, SplitNN suffers from the loss of model performance since multiply parties jointly train the model using transformed data instead of raw data, and a large amount of low-level feature information is discarded. On the other hand, a naive solution of increasing the model performance through aggregating at lower layers in SplitNN (i.e., the data is less transformed and more low-level feature is preserved) makes raw data vulnerable to inference attacks. To mitigate the above trade-off, we propose a new neural network protocol in VFL called Security Forward Aggregation (SFA). It changes the way of aggregating the transformed data and adopts removable masks to protect the raw data. Experiment results show that networks with SFA achieve both data security and high model performance.

Intelligent test requires efficient and effective analysis of high-dimensional data in a large scale. Traditionally, the analysis is often conducted by human experts, but it is not scalable in the era of big data. To tackle this challenge, variable selection has been recently introduced to intelligent test. However, in practice, we encounter scenarios where certain variables (e.g. some specific processing conditions for a device under test) must be maintained after variable selection. We call this conditional variable selection, which has not been well investigated for embedded or deep-learning-based variable selection methods. In this paper, we discuss a novel conditional variable selection framework that can select the most important candidate variables given a set of preselected variables.

Time series prediction is the crucial task for many human activities e.g. weather forecasts or predicting stock prices. One solution to this problem is to use Recurrent Neural Networks (RNNs). Although they can yield accurate predictions, their learning process is slow and complex. Here we propose a Quantum Recurrent Neural Network (QRNN) to address these obstacles. The design of the network is based on the continuous-variable quantum computing paradigm. We demonstrate that the network is capable of learning time dependence of a few types of temporal data. Our numerical simulations show that the QRNN converges to optimal weights in fewer epochs than the classical network. Furthermore, for a small number of trainable parameters it can achieve lower loss than the latter.

Independence testing plays a central role in statistical and causal inference from observational data. Standard independence tests assume that the data samples are independent and identically distributed (i.i.d.) but that assumption is violated in many real-world datasets and applications centered on relational systems. This work examines the problem of estimating independence in data drawn from relational systems by defining sufficient representations for the sets of observations influencing individual instances. Specifically, we define marginal and conditional independence tests for relational data by considering the kernel mean embedding as a flexible aggregation function for relational variables. We propose a consistent, non-parametric, scalable kernel test to operationalize the relational independence test for non-i.i.d. observational data under a set of structural assumptions. We empirically evaluate our proposed method on a variety of synthetic and semi-synthetic networks and demonstrate its effectiveness compared to state-of-the-art kernel-based independence tests.

In underwater acoustic sensor networks (UWASN), energy-reliable data transmission is a challenging task. This is due to acoustic transmission disturbances caused by excessive noise, exceptionally long propagation delays, a high bit error rate, limited bandwidth capability, and interference. One of the most important issues of UWASN for research is how to extend the life span of data transmission. Data transfer from a source node to a destination node in UWASN is a complicated topic for researchers. Many routing algorithms, such as vector base forwarding and depth base routing, have been developed in past years. We propose a genetic algorithm-based optimization method for improving the energy efficiency of data transmission in the routing path from a source node to a destination node.

Vision-Language Pretraining (VLP) models have recently successfully facilitated many cross-modal downstream tasks. Most existing works evaluated their systems by comparing the fine-tuned downstream task performance. However, only average downstream task accuracy provides little information about the pros and cons of each VLP method, let alone provides insights on how the community can improve the systems in the future. Inspired by the CheckList for testing natural language processing, we introduce VL-CheckList, a novel framework to understand the capabilities of VLP models. The proposed method divides the image-texting ability of a VLP model into three categories: objects, attributes, and relations, and uses a novel taxonomy to further break down these three aspects. We conduct comprehensive studies to analyze seven recently popular VLP models via the proposed framework. Results confirm the effectiveness of the proposed method by revealing fine-grained differences among the compared models that were not visible from downstream task-only evaluation. Further results show promising research direction in building better VLP models. Data and Code: https://github.com/om-ai-lab/VL-CheckList

We introduce the framework of performative reinforcement learning where the policy chosen by the learner affects the underlying reward and transition dynamics of the environment. Following the recent literature on performative prediction~\cite{Perdomo et. al., 2020}, we introduce the concept of performatively stable policy. We then consider a regularized version of the reinforcement learning problem and show that repeatedly optimizing this objective converges to a performatively stable policy under reasonable assumptions on the transition dynamics. Our proof utilizes the dual perspective of the reinforcement learning problem and may be of independent interest in analyzing the convergence of other algorithms with decision-dependent environments. We then extend our results for the setting where the learner just performs gradient ascent steps instead of fully optimizing the objective, and for the setting where the learner has access to a finite number of trajectories from the changed environment. For both the settings, we leverage the dual formulation of performative reinforcement learning and establish convergence to a stable solution. Finally, through extensive experiments on a grid-world environment, we demonstrate the dependence of convergence on various parameters e.g. regularization, smoothness, and the number of samples.

We aim to quantitatively measure the practical usability of medical image segmentation models: to what extent, how often, and on which samples a model's predictions can be used/trusted. We first propose a measure, Correctness-Confidence Rank Correlation (CCRC), to capture how predictions' confidence estimates correlate with their correctness scores in rank. A model with a high value of CCRC means its prediction confidences reliably suggest which samples' predictions are more likely to be correct. Since CCRC does not capture the actual prediction correctness, it alone is insufficient to indicate whether a prediction model is both accurate and reliable to use in practice. Therefore, we further propose another method, Usable Region Estimate (URE), which simultaneously quantifies predictions' correctness and reliability of confidence assessments in one estimate. URE provides concrete information on to what extent a model's predictions are usable. In addition, the sizes of usable regions (UR) can be utilized to compare models: A model with a larger UR can be taken as a more usable and hence better model. Experiments on six datasets validate that the proposed evaluation methods perform well, providing a concrete and concise measure for the practical usability of medical image segmentation models. Code is made available at https://github.com/yizhezhang2000/ure.

Adept network management is key for supporting extremely heterogeneous applications with stringent quality of service (QoS) requirements; this is more so when envisioning the complex and ultra-dense 6G mobile heterogeneous network (HetNet). From both the environmental and economical perspectives, non-homogeneous QoS demands obstruct the minimization of the energy footprints and operational costs of the envisioned robust networks. As such, network intelligentization is expected to play an essential role in the realization of such sophisticated aims. The fusion of artificial intelligence (AI) and mobile networks will allow for the dynamic and automatic configuration of network functionalities. Machine learning (ML), one of the backbones of AI, will be instrumental in forecasting changes in network loads and resource utilization, estimating channel conditions, optimizing network slicing, and enhancing security and encryption. However, it is well known that ML tasks themselves incur massive computational burdens and energy costs. To overcome such obstacles, we propose a novel layer-based HetNet architecture which optimally distributes tasks associated with different ML approaches across network layers and entities; such a HetNet boasts multiple access schemes as well as device-to-device (D2D) communications to enhance energy efficiency via collaborative learning and communications.

In this work, we present MotionMixer, an efficient 3D human body pose forecasting model based solely on multi-layer perceptrons (MLPs). MotionMixer learns the spatial-temporal 3D body pose dependencies by sequentially mixing both modalities. Given a stacked sequence of 3D body poses, a spatial-MLP extracts fine grained spatial dependencies of the body joints. The interaction of the body joints over time is then modelled by a temporal MLP. The spatial-temporal mixed features are finally aggregated and decoded to obtain the future motion. To calibrate the influence of each time step in the pose sequence, we make use of squeeze-and-excitation (SE) blocks. We evaluate our approach on Human3.6M, AMASS, and 3DPW datasets using the standard evaluation protocols. For all evaluations, we demonstrate state-of-the-art performance, while having a model with a smaller number of parameters. Our code is available at: https://github.com/MotionMLP/MotionMixer

This article seeks for a distributed learning solution for the visual transformer (ViT) architectures. Compared to convolutional neural network (CNN) architectures, ViTs often have larger model sizes, and are computationally expensive, making federated learning (FL) ill-suited. Split learning (SL) can detour this problem by splitting a model and communicating the hidden representations at the split-layer, also known as smashed data. Notwithstanding, the smashed data of ViT are as large as and as similar as the input data, negating the communication efficiency of SL while violating data privacy. To resolve these issues, we propose a new form of CutSmashed data by randomly punching and compressing the original smashed data. Leveraging this, we develop a novel SL framework for ViT, coined CutMixSL, communicating CutSmashed data. CutMixSL not only reduces communication costs and privacy leakage, but also inherently involves the CutMix data augmentation, improving accuracy and scalability. Simulations corroborate that CutMixSL outperforms baselines such as parallelized SL and SplitFed that integrates FL with SL.

A powerful paradigm for sensorimotor control is to predict actions from observations directly. Training such an end-to-end system allows representations that are useful for the downstream tasks to emerge automatically. In visual navigation, an agent can learn to navigate without any manual designs by correlating how its views change with the actions being taken. However, the lack of inductive bias makes this system data-inefficient and impractical in scenarios like search and rescue, where interacting with the environment to collect data is costly. We hypothesize a sufficient representation of the current view and the goal view for a navigation policy can be learned by predicting the location and size of a crop of the current view that corresponds to the goal. We further show that training such random crop prediction in a self-supervised fashion purely on random noise images transfers well to natural home images. The learned representation can then be bootstrapped to learn a navigation policy efficiently with little interaction data. Code is available at https://github.com/yanweiw/noise2ptz.

In this work, we propose FLVoogd, an updated federated learning method in which servers and clients collaboratively eliminate Byzantine attacks while preserving privacy. In particular, servers use automatic Density-based Spatial Clustering of Applications with Noise (DBSCAN) combined with S2PC to cluster the benign majority without acquiring sensitive personal information. Meanwhile, clients build dual models and perform test-based distance controlling to adjust their local models toward the global one to achieve personalizing. Our framework is automatic and adaptive that servers/clients don't need to tune the parameters during the training. In addition, our framework leverages Secure Multi-party Computation (SMPC) operations, including multiplications, additions, and comparison, where costly operations, like division and square root, are not required. Evaluations are carried out on some conventional datasets from the image classification field. The result shows that FLVoogd can effectively reject malicious uploads in most scenarios; meanwhile, it avoids data leakage from the server-side.

Ultrasound (US) is widely used for its advantages of real-time imaging, radiation-free and portability. In clinical practice, analysis and diagnosis often rely on US sequences rather than a single image to obtain dynamic anatomical information. This is challenging for novices to learn because practicing with adequate videos from patients is clinically unpractical. In this paper, we propose a novel framework to synthesize high-fidelity US videos. Specifically, the synthesis videos are generated by animating source content images based on the motion of given driving videos. Our highlights are three-fold. First, leveraging the advantages of self- and fully-supervised learning, our proposed system is trained in weakly-supervised manner for keypoint detection. These keypoints then provide vital information for handling complex high dynamic motions in US videos. Second, we decouple content and texture learning using the dual decoders to effectively reduce the model learning difficulty. Last, we adopt the adversarial training strategy with GAN losses for further improving the sharpness of the generated videos, narrowing the gap between real and synthesis videos. We validate our method on a large in-house pelvic dataset with high dynamic motion. Extensive evaluation metrics and user study prove the effectiveness of our proposed method.

Unsupervised and unpaired domain translation using generative adversarial neural networks, and more precisely CycleGAN, is state of the art for the stain translation of histopathology images. It often, however, suffers from the presence of cycle-consistent but non structure-preserving errors. We propose an alternative approach to the set of methods which, relying on segmentation consistency, enable the preservation of pathology structures. Focusing on immunohistochemistry (IHC) and multiplexed immunofluorescence (mIF), we introduce a simple yet effective guidance scheme as a loss function that leverages the consistency of stain translation with stain isolation. Qualitative and quantitative experiments show the ability of the proposed approach to improve translation between the two domains.

Graph convolution is a recent scalable method for performing deep feature learning on attributed graphs by aggregating local node information over multiple layers. Such layers only consider attribute information of node neighbors in the forward model and do not incorporate knowledge of global network structure in the learning task. In particular, the modularity function provides a convenient source of information about the community structure of networks. In this work we investigate the effect on the quality of learned representations by the incorporation of community structure preservation objectives of networks in the graph convolutional model. We incorporate the objectives in two ways, through an explicit regularization term in the cost function in the output layer and as an additional loss term computed via an auxiliary layer. We report the effect of community structure preserving terms in the graph convolutional architectures. Experimental evaluation on two attributed bibilographic networks showed that the incorporation of the community-preserving objective improves semi-supervised node classification accuracy in the sparse label regime.

To train robust deep neural networks (DNNs), we systematically study several target modification approaches, which include output regularisation, self and non-self label correction (LC). Three key issues are discovered: (1) Self LC is the most appealing as it exploits its own knowledge and requires no extra models. However, how to automatically decide the trust degree of a learner as training goes is not well answered in the literature. (2) Some methods penalise while the others reward low-entropy predictions, prompting us to ask which one is better. (3) Using the standard training setting, a trained network is of low confidence when severe noise exists, making it hard to leverage its high-entropy self knowledge. To resolve the issue (1), taking two well-accepted propositions--deep neural networks learn meaningful patterns before fitting noise and minimum entropy regularisation principle--we propose a novel end-to-end method named ProSelfLC, which is designed according to learning time and entropy. Specifically, given a data point, we progressively increase trust in its predicted label distribution versus its annotated one if a model has been trained for enough time and the prediction is of low entropy (high confidence). For the issue (2), according to ProSelfLC, we empirically prove that it is better to redefine a meaningful low-entropy status and optimise the learner toward it. This serves as a defence of entropy minimisation. To address the issue (3), we decrease the entropy of self knowledge using a low temperature before exploiting it to correct labels, so that the revised labels redefine a low-entropy target state. We demonstrate the effectiveness of ProSelfLC through extensive experiments in both clean and noisy settings, and on both image and protein datasets. Furthermore, our source code is available at https://github.com/XinshaoAmosWang/ProSelfLC-AT.

Benefiting from the message passing mechanism, Graph Neural Networks (GNNs) have been successful on flourish tasks over graph data. However, recent studies have shown that attackers can catastrophically degrade the performance of GNNs by maliciously modifying the graph structure. A straightforward solution to remedy this issue is to model the edge weights by learning a metric function between pairwise representations of two end nodes, which attempts to assign low weights to adversarial edges. The existing methods use either raw features or representations learned by supervised GNNs to model the edge weights. However, both strategies are faced with some immediate problems: raw features cannot represent various properties of nodes (e.g., structure information), and representations learned by supervised GNN may suffer from the poor performance of the classifier on the poisoned graph. We need representations that carry both feature information and as mush correct structure information as possible and are insensitive to structural perturbations. To this end, we propose an unsupervised pipeline, named STABLE, to optimize the graph structure. Finally, we input the well-refined graph into a downstream classifier. For this part, we design an advanced GCN that significantly enhances the robustness of vanilla GCN without increasing the time complexity. Extensive experiments on four real-world graph benchmarks demonstrate that STABLE outperforms the state-of-the-art methods and successfully defends against various attacks.

Measuring customer experience on mobile data is of utmost importance for global mobile operators. The reference signal received power (RSRP) is one of the important indicators for current mobile network management, evaluation and monitoring. Radio data gathered through the minimization of drive test (MDT), a 3GPP standard technique, is commonly used for radio network analysis. Collecting MDT data in different geographical areas is inefficient and constrained by the terrain conditions and user presence, hence is not an adequate technique for dynamic radio environments. In this paper, we study a generative model for RSRP prediction, exploiting MDT data and a digital twin (DT), and propose a data-driven, two-tier neural network (NN) model. In the first tier, environmental information related to user equipment (UE), base stations (BS) and network key performance indicators (KPI) are extracted through a variational autoencoder (VAE). The second tier is designed as a likelihood model. Here, the environmental features and real MDT data features are adopted, formulating an integrated training process. On validation, our proposed model that uses real-world data demonstrates an accuracy improvement of about 20% or more compared with the empirical model and about 10% when compared with a fully connected prediction network.

Deep learning based solutions are being succesfully implemented for a wide variety of applications. Most notably, clinical use-cases have gained an increased interest and have been the main driver behind some of the cutting-edge data-driven algorithms proposed in the last years. For applications like sparse-view tomographic reconstructions, where the amount of measurement data is small in order to keep acquisition times short and radiation dose low, reduction of the streaking artifacts has prompted the development of data-driven denoising algorithms with the main goal of obtaining diagnostically viable images with only a subset of a full-scan data. We propose WNet, a data-driven dual-domain denoising model which contains a trainable reconstruction layer for sparse-view artifact denoising. Two encoder-decoder networks perform denoising in both sinogram- and reconstruction-domain simultaneously, while a third layer implementing the Filtered Backprojection algorithm is sandwiched between the first two and takes care of the reconstruction operation. We investigate the performance of the network on sparse-view chest CT scans, and we highlight the added benefit of having a trainable reconstruction layer over the more conventional fixed ones. We train and test our network on two clinically relevant datasets and we compare the obtained results with three different types of sparse-view CT denoising and reconstruction algorithms.

A Generative Adversarial Network (GAN) is a deep-learning generative model in the field of Machine Learning (ML) that involves training two Neural Networks (NN) using a sizable data set. In certain fields, such as medicine, the training data may be hospital patient records that are stored across different hospitals. The classic centralized approach would involve sending the data to a centralized server where the model would be trained. However, that would involve breaching the privacy and confidentiality of the patients and their data, which would be unacceptable. Therefore, Federated Learning (FL), an ML technique that trains ML models in a distributed setting without data ever leaving the host device, would be a better alternative to the centralized option. In this ML technique, only parameters and certain metadata would be communicated. In spite of that, there still exist attacks that can infer user data using the parameters and metadata. A fully privacy-preserving solution involves homomorphically encrypting (HE) the data communicated. This paper will focus on the performance loss of training an FL-GAN with three different types of Homomorphic Encryption: Partial Homomorphic Encryption (PHE), Somewhat Homomorphic Encryption (SHE), and Fully Homomorphic Encryption (FHE). We will also test the performance loss of Multi-Party Computations (MPC), as it has homomorphic properties. The performances will be compared to the performance of training an FL-GAN without encryption as well. Our experiments show that the more complex the encryption method is, the longer it takes, with the extra time taken for HE is quite significant in comparison to the base case of FL.

Privacy and security-related concerns are growing as machine learning reaches diverse application domains. The data holders want to train or infer with private data while exploiting accelerators, such as GPUs, that are hosted in the cloud. Cloud systems are vulnerable to attackers that compromise the privacy of data and integrity of computations. Tackling such a challenge requires unifying theoretical privacy algorithms with hardware security capabilities. This paper presents DarKnight, a framework for large DNN training while protecting input privacy and computation integrity. DarKnight relies on cooperative execution between trusted execution environments (TEE) and accelerators, where the TEE provides privacy and integrity verification, while accelerators perform the bulk of the linear algebraic computation to optimize the performance. In particular, DarKnight uses a customized data encoding strategy based on matrix masking to create input obfuscation within a TEE. The obfuscated data is then offloaded to GPUs for fast linear algebraic computation. DarKnight's data obfuscation strategy provides provable data privacy and computation integrity in the cloud servers. While prior works tackle inference privacy and cannot be utilized for training, DarKnight's encoding scheme is designed to support both training and inference.

Most differential privacy mechanisms are applied (i.e., composed) numerous times on sensitive data. We study the design of optimal differential privacy mechanisms in the limit of a large number of compositions. As a consequence of the law of large numbers, in this regime the best privacy mechanism is the one that minimizes the Kullback-Leibler divergence between the conditional output distributions of the mechanism given two different inputs. We formulate an optimization problem to minimize this divergence subject to a cost constraint on the noise. We first prove that additive mechanisms are optimal. Since the optimization problem is infinite dimensional, it cannot be solved directly; nevertheless, we quantize the problem to derive near-optimal additive mechanisms that we call "cactus mechanisms" due to their shape. We show that our quantization approach can be arbitrarily close to an optimal mechanism. Surprisingly, for quadratic cost, the Gaussian mechanism is strictly sub-optimal compared to this cactus mechanism. Finally, we provide numerical results which indicate that cactus mechanism outperforms the Gaussian mechanism for a finite number of compositions.

We provide a simple and general solution for the discovery of scarce topics in unbalanced short-text datasets, namely, a word co-occurrence network-based model CWIBTD, which can simultaneously address the sparsity and unbalance of short-text topics and attenuate the effect of occasional pairwise occurrences of words, allowing the model to focus more on the discovery of scarce topics. Unlike previous approaches, CWIBTD uses co-occurrence word networks to model the topic distribution of each word, which improves the semantic density of the data space and ensures its sensitivity in identify-ing rare topics by improving the way node activity is calculated and normal-izing scarce topics and large topics to some extent. In addition, using the same Gibbs sampling as LDA makes CWIBTD easy to be extended to vari-ous application scenarios. Extensive experimental validation in the unbal-anced short text dataset confirms the superiority of CWIBTD over the base-line approach in discovering rare topics. Our model can be used for early and accurate discovery of emerging topics or unexpected events on social platforms.

The electroencephalogram (EEG) is a powerful method to understand how the brain processes speech. Linear models have recently been replaced for this purpose with deep neural networks and yield promising results. In related EEG classification fields, it is shown that explicitly modeling subject-invariant features improves generalization of models across subjects and benefits classification accuracy. In this work, we adapt factorized hierarchical variational autoencoders to exploit parallel EEG recordings of the same stimuli. We model EEG into two disentangled latent spaces. Subject accuracy reaches 98.96% and 1.60% on respectively the subject and content latent space, whereas binary content classification experiments reach an accuracy of 51.51% and 62.91% on respectively the subject and content latent space.

Real bug fixes found in open source repositories seem to be the perfect source for learning to localize and repair real bugs. However, the absence of large scale bug fix collections has made it difficult to effectively exploit real bug fixes in the training of larger neural models in the past. In contrast, artificial bugs -- produced by mutating existing source code -- can be easily obtained at a sufficient scale and are therefore often preferred in the training of existing approaches. Still, localization and repair models that are trained on artificial bugs usually underperform when faced with real bugs. This raises the question whether bug localization and repair models trained on real bug fixes are more effective in localizing and repairing real bugs. We address this question by introducing RealiT, a pre-train-and-fine-tune approach for effectively learning to localize and repair real bugs from real bug fixes. RealiT is first pre-trained on a large number of artificial bugs produced by traditional mutation operators and then fine-tuned on a smaller set of real bug fixes. Fine-tuning does not require any modifications of the learning algorithm and hence can be easily adopted in various training scenarios for bug localization or repair (even when real training data is scarce). In addition, we found that training on real bug fixes with RealiT is empirically powerful by nearly doubling the localization performance of an existing model on real bugs while maintaining or even improving the repair performance.

We study a ranking problem in the contextual multi-armed bandit setting. A learning agent selects an ordered list of items at each time step and observes stochastic outcomes for each position. In online recommendation systems, showing an ordered list of the most attractive items would not be the best choice since both position and item dependencies result in a complicated reward function. A very naive example is the lack of diversity when all the most attractive items are from the same category. We model position and item dependencies in the ordered list and design UCB and Thompson Sampling type algorithms for this problem. We prove that the regret bound over $T$ rounds and $L$ positions is $\Tilde{O}(L\sqrt{d T})$, which has the same order as the previous works with respect to $T$ and only increases linearly with $L$. Our work generalizes existing studies in several directions, including position dependencies where position discount is a particular case, and proposes a more general contextual bandit model.

30-day hospital readmission is a long standing medical problem that affects patients' morbidity and mortality and costs billions of dollars annually. Recently, machine learning models have been created to predict risk of inpatient readmission for patients with specific diseases, however no model exists to predict this risk across all patients. We developed a bi-directional Long Short Term Memory (LSTM) Network that is able to use readily available insurance data (inpatient visits, outpatient visits, and drug prescriptions) to predict 30 day re-admission for any admitted patient, regardless of reason. The top-performing model achieved an ROC AUC of 0.763 (0.011) when using historical, inpatient, and post-discharge data. The LSTM model significantly outperformed a baseline random forest classifier, indicating that understanding the sequence of events is important for model prediction. Incorporation of 30-days of historical data also significantly improved model performance compared to inpatient data alone, indicating that a patients clinical history prior to admission, including outpatient visits and pharmacy data is a strong contributor to readmission. Our results demonstrate that a machine learning model is able to predict risk of inpatient readmission with reasonable accuracy for all patients using structured insurance billing data. Because billing data or equivalent surrogates can be extracted from sites, such a model could be deployed to identify patients at risk for readmission before they are discharged, or to assign more robust follow up (closer follow up, home health, mailed medications) to at-risk patients after discharge.

In plant breeding the presence of a genotype by environment (GxE) interaction has a strong impact on cultivation decision making and the introduction of new crop cultivars. The combination of linear and bilinear terms has been shown to be very useful in modelling this type of data. A widely-used approach to identify GxE is the Additive Main Effects and Multiplicative Interaction Effects (AMMI) model. However, as data frequently can be high-dimensional, Markov chain Monte Carlo (MCMC) approaches can be computationally infeasible. In this article, we consider a variational inference approach for such a model. We derive variational approximations for estimating the parameters and we compare the approximations to MCMC using both simulated and real data. The new inferential framework we propose is on average two times faster whilst maintaining the same predictive performance as MCMC.

The promise of multimodal models for real-world applications has inspired research in visualizing and understanding their internal mechanics with the end goal of empowering stakeholders to visualize model behavior, perform model debugging, and promote trust in machine learning models. However, modern multimodal models are typically black-box neural networks, which makes it challenging to understand their internal mechanics. How can we visualize the internal modeling of multimodal interactions in these models? Our paper aims to fill this gap by proposing MultiViz, a method for analyzing the behavior of multimodal models by scaffolding the problem of interpretability into 4 stages: (1) unimodal importance: how each modality contributes towards downstream modeling and prediction, (2) cross-modal interactions: how different modalities relate with each other, (3) multimodal representations: how unimodal and cross-modal interactions are represented in decision-level features, and (4) multimodal prediction: how decision-level features are composed to make a prediction. MultiViz is designed to operate on diverse modalities, models, tasks, and research areas. Through experiments on 8 trained models across 6 real-world tasks, we show that the complementary stages in MultiViz together enable users to (1) simulate model predictions, (2) assign interpretable concepts to features, (3) perform error analysis on model misclassifications, and (4) use insights from error analysis to debug models. MultiViz is publicly available, will be regularly updated with new interpretation tools and metrics, and welcomes inputs from the community.

The successful application of machine learning (ML) methods becomes increasingly dependent on their interpretability or explainability. Designing explainable ML systems is instrumental to ensuring transparency of automated decision-making that targets humans. The explainability of ML methods is also an essential ingredient for trustworthy artificial intelligence. A key challenge in ensuring explainability is its dependence on the specific human user ("explainee"). The users of machine learning methods might have vastly different background knowledge about machine learning principles. One user might have a university degree in machine learning or related fields, while another user might have never received formal training in high-school mathematics. This paper applies information-theoretic concepts to develop a novel measure for the subjective explainability of the predictions delivered by a ML method. We construct this measure via the conditional entropy of predictions, given a user feedback. The user feedback might be obtained from user surveys or biophysical measurements. Our main contribution is the explainable empirical risk minimization (EERM) principle of learning a hypothesis that optimally balances between the subjective explainability and risk. The EERM principle is flexible and can be combined with arbitrary machine learning models. We present several practical implementations of EERM for linear models and decision trees. Numerical experiments demonstrate the application of EERM to detecting the use of inappropriate language on social media.

Offline imitation learning (IL) is a powerful method to solve decision-making problems from expert demonstrations without reward labels. Existing offline IL methods suffer from severe performance degeneration under limited expert data due to covariate shift. Including a learned dynamics model can potentially improve the state-action space coverage of expert data, however, it also faces challenging issues like model approximation/generalization errors and suboptimality of rollout data. In this paper, we propose the Discriminator-guided Model-based offline Imitation Learning (DMIL) framework, which introduces a discriminator to simultaneously distinguish the dynamics correctness and suboptimality of model rollout data against real expert demonstrations. DMIL adopts a novel cooperative-yet-adversarial learning strategy, which uses the discriminator to guide and couple the learning process of the policy and dynamics model, resulting in improved model performance and robustness. Our framework can also be extended to the case when demonstrations contain a large proportion of suboptimal data. Experimental results show that DMIL and its extension achieve superior performance and robustness compared to state-of-the-art offline IL methods under small datasets.

Graph Neural Networks (GNNs) have achieved tremendous success in many graph mining tasks, benefitting from the message passing strategy that fuses the local structure and node features for much better graph representation learning. Despite the excellent performance of GNNs, but similar to other type of deep neural networks, the robustness of GNNs is unsatisfactory. It have been disclosed by many works that GNNs are vulnerable to unnoticeable perturbations on both graph structure and node features. Many adversarial attacks have been proposed to disclose the fragility of GNNs under different perturbation strategies to create adversarial examples. However, less work has been done to show the vulnerability of GNNs under backdoor attack. To fill this gap, in this paper, we present GHAT, transferable GrapH bAckdoor aTtack. The core principle of GHAT is to poison training dataset with perturbation triggers that can lead to effective and transferable backdoor attack. The perturbation trigger for a graph is generated by performing the perturbation actions on the graph structure via a gradient based score matrix. Compared with the prior works, GHAT is different in several ways: it exploits a surrogate GCN model to generate perturbation trigger for black-box based backdoor attack; it generates sample-specific perturbation triggers which do not have fixed pattern; the attack of GHAT can be transferable to different GNN models when trained with the poisoned training dataset forged by GHAT. Through extensive evaluation on four real-world datasets, we demonstrate that GHAT shows much better attack effectiveness in regard to transferable backdoor attack on GNNs.

Machine learning is a field of artificial intelligence (AI) that is becoming essential for several critical systems, making it a good target for threat actors. Threat actors exploit different Tactics, Techniques, and Procedures (TTPs) against the confidentiality, integrity, and availability of Machine Learning (ML) systems. During the ML cycle, they exploit adversarial TTPs to poison data and fool ML-based systems. In recent years, multiple security practices have been proposed for traditional systems but they are not enough to cope with the nature of ML-based systems. In this paper, we conduct an empirical study of threats reported against ML-based systems with the aim to understand and characterize the nature of ML threats and identify common mitigation strategies. The study is based on 89 real-world ML attack scenarios from the MITRE's ATLAS database, the AI Incident Database, and the literature; 854 ML repositories from the GitHub search and the Python Packaging Advisory database, selected based on their reputation. Attacks from the AI Incident Database and the literature are used to identify vulnerabilities and new types of threats that were not documented in ATLAS. Results show that convolutional neural networks were one of the most targeted models among the attack scenarios. ML repositories with the largest vulnerability prominence include TensorFlow, OpenCV, and Notebook. In this paper, we also report the most frequent vulnerabilities in the studied ML repositories, the most targeted ML phases and models, the most used TTPs in ML phases and attack scenarios. This information is particularly important for red/blue teams to better conduct attacks/defenses, for practitioners to prevent threats during ML development, and for researchers to develop efficient defense mechanisms.

Machine learning algorithms are routinely used for business decisions that may directly affect individuals, for example, because a credit scoring algorithm refuses them a loan. It is then relevant from an ethical (and legal) point of view to ensure that these algorithms do not discriminate based on sensitive attributes (like sex or race), which may occur unwittingly and unknowingly by the operator and the management. Statistical tools and methods are then required to detect and eliminate such potential biases.

Differentiable simulation is a promising toolkit for fast gradient-based policy optimization and system identification. However, existing approaches to differentiable simulation have largely tackled scenarios where obtaining smooth gradients has been relatively easy, such as systems with mostly smooth dynamics. In this work, we study the challenges that differentiable simulation presents when it is not feasible to expect that a single descent reaches a global optimum, which is often a problem in contact-rich scenarios. We analyze the optimization landscapes of diverse scenarios that contain both rigid bodies and deformable objects. In dynamic environments with highly deformable objects and fluids, differentiable simulators produce rugged landscapes with nonetheless useful gradients in some parts of the space. We propose a method that combines Bayesian optimization with semi-local 'leaps' to obtain a global search method that can use gradients effectively, while also maintaining robust performance in regions with noisy gradients. We show that our approach outperforms several gradient-based and gradient-free baselines on an extensive set of experiments in simulation, and also validate the method using experiments with a real robot and deformables. Videos and supplementary materials are available at https://tinyurl.com/globdiff

This article reports nonintuitive characteristic of a splashing drop on a solid surface discovered through extracting image features using a feedforward neural network (FNN). Ethanol of area-equivalent radius about 1.29 mm was dropped from impact heights ranging from 4 cm to 60 cm (splashing threshold 20 cm) and impacted on a hydrophilic surface. The images captured when half of the drop impacted the surface were labeled according to their outcome, splashing or nonsplashing, and were used to train an FNN. A classification accuracy higher than 96% was achieved. To extract the image features identified by the FNN for classification, the weight matrix of the trained FNN for identifying splashing drops was visualized. Remarkably, the visualization showed that the trained FNN identified the contour height of the main body of the impacting drop as an important characteristic differentiating between splashing and nonsplashing drops, which has not been reported in previous studies. This feature was found throughout the impact, even when one and three-quarters of the drop impacted the surface. To confirm the importance of this image feature, the FNN was retrained to classify using only the main body without checking for the presence of ejected secondary droplets. The accuracy was still higher than 82%, confirming that the contour height is an important feature distinguishing splashing from nonsplashing drops. Several aspects of drop impact are analyzed and discussed with the aim of identifying the possible mechanism underlying the difference in contour height between splashing and nonsplashing drops.

This work takes a critical look at the application of conventional machine learning methods to wireless communication problems through the lens of reliability and robustness. Deep learning techniques adopt a frequentist framework, and are known to provide poorly calibrated decisions that do not reproduce the true uncertainty caused by limitations in the size of the training data. Bayesian learning, while in principle capable of addressing this shortcoming, is in practice impaired by model misspecification and by the presence of outliers. Both problems are pervasive in wireless communication settings, in which the capacity of machine learning models is subject to resource constraints and training data is affected by noise and interference. In this context, we explore the application of the framework of robust Bayesian learning. After a tutorial-style introduction to robust Bayesian learning, we showcase the merits of robust Bayesian learning on several important wireless communication problems in terms of accuracy, calibration, and robustness to outliers and misspecification.

Recent works show that random neural networks are vulnerable against adversarial attacks [Daniely and Schacham, 2020] and that such attacks can be easily found using a single step of gradient descent [Bubeck et al., 2021]. In this work, we take it one step further and show that a single gradient step can find adversarial examples for networks trained in the so-called lazy regime. This regime is interesting because even though the neural network weights remain close to the initialization, there exist networks with small generalization error, which can be found efficiently using first-order methods. Our work challenges the model of the lazy regime, the dominant regime in which neural networks are provably efficiently learnable. We show that the networks trained in this regime, even though they enjoy good theoretical computational guarantees, remain vulnerable to adversarial examples. To the best of our knowledge, this is the first work to prove that such well-generalizable neural networks are still vulnerable to adversarial attacks.

The past several years have witnessed the success of transformer-based models, and their scale and application scenarios continue to grow aggressively. The current landscape of transformer models is increasingly diverse: the model size varies drastically with the largest being of hundred-billion parameters; the model characteristics differ due to the sparsity introduced by the Mixture-of-Experts; the target application scenarios can be latency-critical or throughput-oriented; the deployment hardware could be single- or multi-GPU systems with different types of memory and storage, etc. With such increasing diversity and the fast-evolving pace of transformer models, designing a highly performant and efficient inference system is extremely challenging. In this paper, we present DeepSpeed Inference, a comprehensive system solution for transformer model inference to address the above-mentioned challenges. DeepSpeed Inference consists of (1) a multi-GPU inference solution to minimize latency while maximizing the throughput of both dense and sparse transformer models when they fit in aggregate GPU memory, and (2) a heterogeneous inference solution that leverages CPU and NVMe memory in addition to the GPU memory and compute to enable high inference throughput with large models which do not fit in aggregate GPU memory. DeepSpeed Inference reduces latency by up to 7.3X over the state-of-the-art for latency-oriented scenarios and increases throughput by over 1.5x for throughput-oriented scenarios. Moreover, it enables trillion parameter scale inference under real-time latency constraints by leveraging hundreds of GPUs, an unprecedented scale for inference. It can inference 25x larger models than with GPU-only solutions, while delivering a high throughput of 84 TFLOPS (over $50\%$ of A6000 peak).

Quantum algorithms based on variational approaches are one of the most promising methods to construct quantum solutions and have found a myriad of applications in the last few years. Despite the adaptability and simplicity, their scalability and the selection of suitable ans\"atzs remain key challenges. In this work, we report an algorithmic framework based on nested Monte-Carlo Tree Search (MCTS) coupled with the combinatorial multi-armed bandit (CMAB) model for the automated design of quantum circuits. Through numerical experiments, we demonstrated our algorithm applied to various kinds of problems, including the ground energy problem in quantum chemistry, quantum optimisation on a graph, solving systems of linear equations, and finding encoding circuit for quantum error detection codes. Compared to the existing approaches, the results indicate that our circuit design algorithm can explore larger search spaces and optimise quantum circuits for larger systems, showing both versatility and scalability.

Standard deep learning-based classification approaches require collecting all samples from all classes in advance and are trained offline. This paradigm may not be practical in real-world clinical applications, where new classes are incrementally introduced through the addition of new data. Class incremental learning is a strategy allowing learning from such data. However, a major challenge is catastrophic forgetting, i.e., performance degradation on previous classes when adapting a trained model to new data. Prior methodologies to alleviate this challenge save a portion of training data require perpetual storage of such data that may introduce privacy issues. Here, we propose a novel data-free class incremental learning framework that first synthesizes data from the model trained on previous classes to generate a \ours. Subsequently, it updates the model by combining the synthesized data with new class data. Furthermore, we incorporate a cosine normalized Cross-entropy loss to mitigate the adverse effects of the imbalance, a margin loss to increase separation among previous classes and new ones, and an intra-domain contrastive loss to generalize the model trained on the synthesized data to real data. We compare our proposed framework with state-of-the-art methods in class incremental learning, where we demonstrate improvement in accuracy for the classification of 11,062 echocardiography cine series of patients.

Densely annotating LiDAR point clouds is costly, which restrains the scalability of fully-supervised learning methods. In this work, we study the underexplored semi-supervised learning (SSL) in LiDAR segmentation. Our core idea is to leverage the strong spatial cues of LiDAR point clouds to better exploit unlabeled data. We propose LaserMix to mix laser beams from different LiDAR scans, and then encourage the model to make consistent and confident predictions before and after mixing. Our framework has three appealing properties: 1) Generic: LaserMix is agnostic to LiDAR representations (e.g., range view and voxel), and hence our SSL framework can be universally applied. 2) Statistically grounded: We provide a detailed analysis to theoretically explain the applicability of the proposed framework. 3) Effective: Comprehensive experimental analysis on popular LiDAR segmentation datasets (nuScenes, SemanticKITTI, and ScribbleKITTI) demonstrates our effectiveness and superiority. Notably, we achieve competitive results over fully-supervised counterparts with 2x to 5x fewer labels and improve the supervised-only baseline significantly by 10.8% on average. We hope this concise yet high-performing framework could facilitate future research in semi-supervised LiDAR segmentation. Code will be publicly available.

Recurrent neural networks have been shown to be effective architectures for many tasks in high energy physics, and thus have been widely adopted. Their use in low-latency environments has, however, been limited as a result of the difficulties of implementing recurrent architectures on field-programmable gate arrays (FPGAs). In this paper we present an implementation of two types of recurrent neural network layers -- long short-term memory and gated recurrent unit -- within the hls4ml framework. We demonstrate that our implementation is capable of producing effective designs for both small and large models, and can be customized to meet specific design requirements for inference latencies and FPGA resources. We show the performance and synthesized designs for multiple neural networks, many of which are trained specifically for jet identification tasks at the CERN Large Hadron Collider.

High percentage penetrations of renewable energy generations introduce significant uncertainty into power systems. It requires grid operators to solve alternative current optimal power flow (AC-OPF) problems more frequently for economical and reliable operation in both transmission and distribution grids. In this paper, we develop a Deep Neural Network (DNN) approach, called DeepOPF, for solving AC-OPF problems in a fraction of the time used by conventional solvers. A key difficulty for applying machine learning techniques for solving AC-OPF problems lies in ensuring that the obtained solutions respect the equality and inequality physical and operational constraints. Generalized the 2-stage procedure in [1], [2], DeepOPF first trains a DNN model to predict a set of independent operating variables and then directly compute the remaining dependable ones by solving power flow equations. Such an approach not only preserves the power-flow balance equality constraints but also reduces the number of variables to predict by the DNN, cutting down the number of neurons and training data needed. DeepOPF then employs a penalty approach with a zero-order gradient estimation technique in the training process to preserve the remaining inequality constraints. As another contribution, we drive a condition for tuning the size of the DNN according to the desired approximation accuracy, which measures the DNN generalization capability. It provides theoretical justification for using DNN to solve the AC-OPF problem. Simulation results of IEEE 30/118/300-bus and a synthetic 2000-bus test cases show that DeepOPF speeds up the computing time by up to two orders of magnitude as compared to a state-of-the-art solver, at the expense of $<$0.1% cost difference.

Across a multitude of work environments, expert knowledge is imperative for humans to conduct tasks with high performance and ensure business success. These humans possess task-specific expert knowledge (TSEK) and hence, represent subject matter experts (SMEs). However, not only demographic changes but also personnel downsizing strategies lead and will continue to lead to departures of SMEs within organizations, which constitutes the challenge of how to retain that expert knowledge and train novices to keep the competitive advantage elicited by that expert knowledge. SMEs training novices is time- and cost-intensive, which intensifies the need for alternatives. Human-AI collaboration (HAIC) poses a way out of this dilemma, facilitating alternatives to preserve expert knowledge and teach it to novices for tasks conducted by SMEs beforehand. In this workshop paper, we (1) propose a framework on how HAIC can be utilized to train novices on particular tasks, (2) illustrate the role of explicit and tacit knowledge in this training process via HAIC, and (3) outline a preliminary experiment design to assess the ability of AI systems in HAIC to act as a trainer to transfer TSEK to novices who do not possess prior TSEK.

This paper develops a decentralized reinforcement learning (RL) scheme for multi-intersection adaptive traffic signal control (TSC), called "CVLight", that leverages data collected from connected vehicles (CVs). The state and reward design facilitates coordination among agents and considers travel delays collected by CVs. A novel algorithm, Asymmetric Advantage Actor-critic (Asym-A2C), is proposed where both CV and non-CV information is used to train the critic network, while only CV information is used to execute optimal signal timing. Comprehensive experiments show the superiority of CVLight over state-of-the-art algorithms under a 2-by-2 synthetic road network with various traffic demand patterns and penetration rates. The learned policy is then visualized to further demonstrate the advantage of Asym-A2C. A pre-train technique is applied to improve the scalability of CVLight, which significantly shortens the training time and shows the advantage in performance under a 5-by-5 road network. A case study is performed on a 2-by-2 road network located in State College, Pennsylvania, USA, to further demonstrate the effectiveness of the proposed algorithm under real-world scenarios. Compared to other baseline models, the trained CVLight agent can efficiently control multiple intersections solely based on CV data and achieve the best performance, especially under low CV penetration rates.

This paper introduces a unified source-filter network with a harmonic-plus-noise source excitation generation mechanism. In our previous work, we proposed unified Source-Filter GAN (uSFGAN) for developing a high-fidelity neural vocoder with flexible voice controllability using a unified source-filter neural network architecture. However, the capability of uSFGAN to model the aperiodic source excitation signal is insufficient, and there is still a gap in sound quality between the natural and generated speech. To improve the source excitation modeling and generated sound quality, a new source excitation generation network separately generating periodic and aperiodic components is proposed. The advanced adversarial training procedure of HiFiGAN is also adopted to replace that of Parallel WaveGAN used in the original uSFGAN. Both objective and subjective evaluation results show that the modified uSFGAN significantly improves the sound quality of the basic uSFGAN while maintaining the voice controllability.

Bayesian optimization (BO) is a widely used approach for computationally expensive black-box optimization such as simulator calibration and hyperparameter optimization of deep learning methods. In BO, a dynamically updated computationally cheap surrogate model is employed to learn the input-output relationship of the black-box function; this surrogate model is used to explore and exploit the promising regions of the input space. Multipoint BO methods adopt a single manager/multiple workers strategy to achieve high-quality solutions in shorter time. However, the computational overhead in multipoint generation schemes is a major bottleneck in designing BO methods that can scale to thousands of workers. We present an asynchronous-distributed BO (ADBO) method wherein each worker runs a search and asynchronously communicates the input-output values of black-box evaluations from all other workers without the manager. We scale our method up to 4,096 workers and demonstrate improvement in the quality of the solution and faster convergence. We demonstrate the effectiveness of our approach for tuning the hyperparameters of neural networks from the Exascale computing project CANDLE benchmarks.

Latent Gaussian models and boosting are widely used techniques in statistics and machine learning. Tree-boosting shows excellent prediction accuracy on many data sets, but potential drawbacks are that it assumes conditional independence of samples, produces discontinuous predictions for, e.g., spatial data, and it can have difficulty with high-cardinality categorical variables. Latent Gaussian models, such as Gaussian process and grouped random effects models, are flexible prior models which explicitly model dependence among samples and which allow for efficient learning of predictor functions and for making probabilistic predictions. However, existing latent Gaussian models usually assume either a zero or a linear prior mean function which can be an unrealistic assumption. This article introduces a novel approach that combines boosting and latent Gaussian models to remedy the above-mentioned drawbacks and to leverage the advantages of both techniques. We obtain increased prediction accuracy compared to existing approaches in both simulated and real-world data experiments.

Discrete choice models (DCMs) require a priori knowledge of the utility functions, especially how tastes vary across individuals. Utility misspecification may lead to biased estimates, inaccurate interpretations and limited predictability. In this paper, we utilize a neural network to learn taste representation. Our formulation consists of two modules: a neural network (TasteNet) that learns taste parameters (e.g., time coefficient) as flexible functions of individual characteristics; and a multinomial logit (MNL) model with utility functions defined with expert knowledge. Taste parameters learned by the neural network are fed into the choice model and link the two modules. Our approach extends the L-MNL model (Sifringer et al., 2020) by allowing the neural network to learn the interactions between individual characteristics and alternative attributes. Moreover, we formalize and strengthen the interpretability condition - requiring realistic estimates of behavior indicators (e.g., value-of-time, elasticity) at the disaggregated level, which is crucial for a model to be suitable for scenario analysis and policy decisions. Through a unique network architecture and parameter transformation, we incorporate prior knowledge and guide the neural network to output realistic behavior indicators at the disaggregated level. We show that TasteNet-MNL reaches the ground-truth model's predictability and recovers the nonlinear taste functions on synthetic data. Its estimated value-of-time and choice elasticities at the individual level are close to the ground truth. On a publicly available Swissmetro dataset, TasteNet-MNL outperforms benchmarking MNLs and Mixed Logit model's predictability. It learns a broader spectrum of taste variations within the population and suggests a higher average value-of-time.

The Kalman Filter (KF) parameters are traditionally determined by noise estimation, since under the KF assumptions, the state prediction errors are minimized when the parameters correspond to the noise covariance. However, noise estimation remains the gold-standard regardless of the assumptions - even when it is not equivalent to errors minimization. We demonstrate that even seemingly simple problems may include multiple assumptions violations - which are sometimes hard to even notice. We show theoretically and empirically that even a minor violation may largely shift the optimal parameters. We propose a gradient-based method along with the Cholesky parameterization to explicitly optimize the state prediction errors. We show consistent improvement over noise estimation in tens of experiments in 3 different domains. Finally, we demonstrate that optimization makes the KF competitive with an LSTM model - even in non linear problems.

In robotic domains, learning and planning are complicated by continuous state spaces, continuous action spaces, and long task horizons. In this work, we address these challenges with Neuro-Symbolic Relational Transition Models (NSRTs), a novel class of models that are data-efficient to learn, compatible with powerful robotic planning methods, and generalizable over objects. NSRTs have both symbolic and neural components, enabling a bilevel planning scheme where symbolic AI planning in an outer loop guides continuous planning with neural models in an inner loop. Experiments in four robotic planning domains show that NSRTs can be learned after only tens or hundreds of training episodes, and then used for fast planning in new tasks that require up to 60 actions and involve many more objects than were seen during training. Video: https://tinyurl.com/chitnis-nsrts

Symbolic regression is a machine learning technique that can learn the governing formulas of data and thus has the potential to transform scientific discovery. However, symbolic regression is still limited in the complexity and dimensionality of the systems that it can analyze. Deep learning on the other hand has transformed machine learning in its ability to analyze extremely complex and high-dimensional datasets. We propose a neural network architecture to extend symbolic regression to parametric systems where some coefficient may vary but the structure of the underlying governing equation remains constant. We demonstrate our method on various analytic expressions, ODEs, and PDEs with varying coefficients and show that it extrapolates well outside of the training domain. The neural network-based architecture can also integrate with other deep learning architectures so that it can analyze high-dimensional data while being trained end-to-end. To this end we integrate our architecture with convolutional neural networks to analyze 1D images of varying spring systems.

Factorizing a large matrix into small matrices is a popular strategy for model compression. Singular value decomposition (SVD) plays a vital role in this compression strategy, approximating a learned matrix with fewer parameters. However, SVD minimizes the squared error toward reconstructing the original matrix without gauging the importance of the parameters, potentially giving a larger reconstruction error for those who affect the task accuracy more. In other words, the optimization objective of SVD is not aligned with the trained model's task accuracy. We analyze this previously unexplored problem, make observations, and address it by introducing Fisher information to weigh the importance of parameters affecting the model prediction. This idea leads to our method: Fisher-Weighted SVD (FWSVD). Although the factorized matrices from our approach do not result in smaller reconstruction errors, we find that our resulting task accuracy is much closer to the original model's performance. We perform analysis with the transformer-based language models, showing our weighted SVD largely alleviates the mismatched optimization objectives and can maintain model performance with a higher compression rate. Our method can directly compress a task-specific model while achieving better performance than other compact model strategies requiring expensive model pre-training. Moreover, the evaluation of compressing an already compact model shows our method can further reduce 9% to 30% parameters with an insignificant impact on task accuracy.

We study a variant of a recently introduced min-max optimization framework where the max-player is constrained to update its parameters in a greedy manner until it reaches a first-order stationary point. Our equilibrium definition for this framework depends on a proposal distribution which the min-player uses to choose directions in which to update its parameters. We show that, given a smooth and bounded nonconvex-nonconcave objective function, access to any proposal distribution for the min-player's updates, and stochastic gradient oracle for the max-player, our algorithm converges to the aforementioned approximate local equilibrium in a number of iterations that does not depend on the dimension. The equilibrium point found by our algorithm depends on the proposal distribution, and when applying our algorithm to train GANs we choose the proposal distribution to be a distribution of stochastic gradients. We empirically evaluate our algorithm on challenging nonconvex-nonconcave test-functions and loss functions arising in GAN training. Our algorithm converges on these test functions and, when used to train GANs, trains stably on synthetic and real-world datasets and avoids mode collapse

Several regularization methods have recently been introduced which force the latent activations of an autoencoder or deep neural network to conform to either a Gaussian or hyperspherical distribution, or to minimize the implicit rank of the distribution in latent space. In the present work, we introduce a novel regularizing loss function which simulates a pairwise repulsive force between items and an attractive force of each item toward the origin. We show that minimizing this loss function in isolation achieves a hyperspherical distribution. Moreover, when used as a regularizing term, the scaling factor can be adjusted to allow greater flexibility and tolerance of eccentricity, thus allowing the latent variables to be stratified according to their relative importance, while still promoting diversity. We apply this method of Eccentric Regularization to an autoencoder, and demonstrate its effectiveness in image generation, representation learning and downstream classification tasks.

Stochastic first-order methods are standard for training large-scale machine learning models. Random behavior may cause a particular run of an algorithm to result in a highly suboptimal objective value, whereas theoretical guarantees are usually proved for the expectation of the objective value. Thus, it is essential to theoretically guarantee that algorithms provide small objective residual with high probability. Existing methods for non-smooth stochastic convex optimization have complexity bounds with the dependence on the confidence level that is either negative-power or logarithmic but under an additional assumption of sub-Gaussian (light-tailed) noise distribution that may not hold in practice. In our paper, we resolve this issue and derive the first high-probability convergence results with logarithmic dependence on the confidence level for non-smooth convex stochastic optimization problems with non-sub-Gaussian (heavy-tailed) noise. To derive our results, we propose novel stepsize rules for two stochastic methods with gradient clipping. Moreover, our analysis works for generalized smooth objectives with H\"older-continuous gradients, and for both methods, we provide an extension for strongly convex problems. Finally, our results imply that the first (accelerated) method we consider also has optimal iteration and oracle complexity in all the regimes, and the second one is optimal in the non-smooth setting.

Normalization of polynomials plays a vital role in the approximate basis computation of vanishing ideals. Coefficient normalization, which normalizes a polynomial with its coefficient norm, is the most common method in computer algebra. This study proposes the gradient-weighted normalization method for the approximate border basis computation of vanishing ideals, inspired by recent developments in machine learning. The data-dependent nature of gradient-weighted normalization leads to better stability against perturbation and consistency in the scaling of input points, which cannot be attained by coefficient normalization. Only a subtle change is needed to introduce gradient normalization in the existing algorithms with coefficient normalization. The analysis of algorithms still works with a small modification, and the order of magnitude of time complexity of algorithms remains unchanged. We also prove that, with coefficient normalization, which does not provide the scaling consistency property, scaling of points (e.g., as a preprocessing) can cause an approximate basis computation to fail. This study is the first to theoretically highlight the crucial effect of scaling in approximate basis computation and presents the utility of data-dependent normalization.

Directly motivated by security-related applications from the Homeland Security Enterprise, we focus on the privacy-preserving analysis of graph data, which provides the crucial capacity to represent rich attributes and relationships. In particular, we discuss two directions, namely privacy-preserving graph generation and federated graph learning, which can jointly enable the collaboration among multiple parties each possessing private graph data. For each direction, we identify both "quick wins" and "hard problems". Towards the end, we demonstrate a user interface that can facilitate model explanation, interpretation, and visualization. We believe that the techniques developed in these directions will significantly enhance the capabilities of the Homeland Security Enterprise to tackle and mitigate the various security risks.

Graph contrastive learning has emerged as a powerful tool for unsupervised graph representation learning. The key to the success of graph contrastive learning is to acquire high-quality positive and negative samples as contrasting pairs for the purpose of learning underlying structural semantics of the input graph. Recent works usually sample negative samples from the same training batch with the positive samples, or from an external irrelevant graph. However, a significant limitation lies in such strategies, which is the unavoidable problem of sampling false negative samples. In this paper, we propose a novel method to utilize \textbf{C}ounterfactual mechanism to generate artificial hard negative samples for \textbf{G}raph \textbf{C}ontrastive learning, namely \textbf{CGC}, which has a different perspective compared to those sampling-based strategies. We utilize counterfactual mechanism to produce hard negative samples, which ensures that the generated samples are similar to, but have labels that different from the positive sample. The proposed method achieves satisfying results on several datasets compared to some traditional unsupervised graph learning methods and some SOTA graph contrastive learning methods. We also conduct some supplementary experiments to give an extensive illustration of the proposed method, including the performances of CGC with different hard negative samples and evaluations for hard negative samples generated with different similarity measurements.

Recent work introduced the epinet as a new approach to uncertainty modeling in deep learning. An epinet is a small neural network added to traditional neural networks, which, together, can produce predictive distributions. In particular, using an epinet can greatly improve the quality of joint predictions across multiple inputs, a measure of how well a neural network knows what it does not know. In this paper, we examine whether epinets can offer similar advantages under distributional shifts. We find that, across ImageNet-A/O/C, epinets generally improve robustness metrics. Moreover, these improvements are more significant than those afforded by even very large ensembles at orders of magnitude lower computational costs. However, these improvements are relatively small compared to the outstanding issues in distributionally-robust deep learning. Epinets may be a useful tool in the toolbox, but they are far from the complete solution.

There has been a growing interest in the use of Deep Neural Networks (DNNs) to solve Partial Differential Equations (PDEs). Despite the promise that such approaches hold, there are various aspects where they could be improved. Two such shortcomings are (i) their computational inefficiency relative to classical numerical methods, and (ii) the non-interpretability of a trained DNN model. In this work we present ASPINN, an anisotropic extension of our earlier work called SPINN--Sparse, Physics-informed, and Interpretable Neural Networks--to solve PDEs that addresses both these issues. ASPINNs generalize radial basis function networks. We demonstrate using a variety of examples involving elliptic and hyperbolic PDEs that the special architecture we propose is more efficient than generic DNNs, while at the same time being directly interpretable. Further, they improve upon the SPINN models we proposed earlier in that fewer nodes are require to capture the solution using ASPINN than using SPINN, thanks to the anisotropy of the local zones of influence of each node. The interpretability of ASPINN translates to a ready visualization of their weights and biases, thereby yielding more insight into the nature of the trained model. This in turn provides a systematic procedure to improve the architecture based on the quality of the computed solution. ASPINNs thus serve as an effective bridge between classical numerical algorithms and modern DNN based methods to solve PDEs. In the process, we also streamline the training of ASPINNs into a form that is closer to that of supervised learning algorithms.

Analyzing multi-way measurements with variations across one mode of the dataset is a challenge in various fields including data mining, neuroscience and chemometrics. For example, measurements may evolve over time or have unaligned time profiles. The PARAFAC2 model has been successfully used to analyze such data by allowing the underlying factor matrices in one mode (i.e., the evolving mode) to change across slices. The traditional approach to fit a PARAFAC2 model is to use an alternating least squares-based algorithm, which handles the constant cross-product constraint of the PARAFAC2 model by implicitly estimating the evolving factor matrices. This approach makes imposing regularization on these factor matrices challenging. There is currently no algorithm to flexibly impose such regularization with general penalty functions and hard constraints. In order to address this challenge and to avoid the implicit estimation, in this paper, we propose an algorithm for fitting PARAFAC2 based on alternating optimization with the alternating direction method of multipliers (AO-ADMM). With numerical experiments on simulated data, we show that the proposed PARAFAC2 AO-ADMM approach allows for flexible constraints, recovers the underlying patterns accurately, and is computationally efficient compared to the state-of-the-art. We also apply our model to two real-world datasets from neuroscience and chemometrics, and show that constraining the evolving mode improves the interpretability of the extracted patterns.

Large-scale speech self-supervised learning (SSL) has emerged to the main field of speech processing, however, the problem of computational cost arising from its vast size makes a high entry barrier to academia. In addition, existing distillation techniques of speech SSL models compress the model by reducing layers, which induces performance degradation in linguistic pattern recognition tasks such as phoneme recognition (PR). In this paper, we propose FitHuBERT, which makes thinner in dimension throughout almost all model components and deeper in layer compared to prior speech SSL distillation works. Moreover, we employ a time-reduction layer to speed up inference time and propose a method of hint-based distillation for less performance degradation. Our method reduces the model to 23.8% in size and 35.9% in inference time compared to HuBERT. Also, we achieve 12.1% word error rate and 13.3% phoneme error rate on the SUPERB benchmark which is superior than prior work.

We study ReLU deep neural networks (DNNs) by investigating their connections with the hierarchical basis method in finite element methods. First, we show that the approximation schemes of ReLU DNNs for $x^2$ and $xy$ are composition versions of the hierarchical basis approximation for these two functions. Based on this fact, we obtain a geometric interpretation and systematic proof for the approximation result of ReLU DNNs for polynomials, which plays an important role in a series of recent exponential approximation results of ReLU DNNs. Through our investigation of connections between ReLU DNNs and the hierarchical basis approximation for $x^2$ and $xy$, we show that ReLU DNNs with this special structure can be applied only to approximate quadratic functions. Furthermore, we obtain a concise representation to explicitly reproduce any linear finite element function on a two-dimensional uniform mesh by using ReLU DNNs with only two hidden layers.

Federated learning (FL) is an emerging machine learning paradigm involving multiple clients, e.g., mobile phone devices, with an incentive to collaborate in solving a machine learning problem coordinated by a central server. FL was proposed in 2016 by Kone\v{c}n\'{y} et al. and McMahan et al. as a viable privacy-preserving alternative to traditional centralized machine learning since, by construction, the training data points are decentralized and never transferred by the clients to a central server. Therefore, to a certain degree, FL mitigates the privacy risks associated with centralized data collection. Unfortunately, optimization for FL faces several specific issues that centralized optimization usually does not need to handle. In this thesis, we identify several of these challenges and propose new methods and algorithms to address them, with the ultimate goal of enabling practical FL solutions supported with mathematically rigorous guarantees.

Financial time series simulation is a central topic since it extends the limited real data for training and evaluation of trading strategies. It is also challenging because of the complex statistical properties of the real financial data. We introduce two generative adversarial networks (GANs), which utilize the convolutional networks with attention and the transformers, for financial time series simulation. The GANs learn the statistical properties in a data-driven manner and the attention mechanism helps to replicate the long-range dependencies. The proposed GANs are tested on the S&P 500 index and option data, examined by scores based on the stylized facts and are compared with the pure convolutional GAN, i.e. QuantGAN. The attention-based GANs not only reproduce the stylized facts, but also smooth the autocorrelation of returns.

We consider a general non-linear model where the signal is a finite mixture of an unknown, possibly increasing, number of features issued from a continuous dictionary parameterized by a real nonlinear parameter. The signal is observed with Gaussian (possibly correlated) noise in either a continuous or a discrete setup. We propose an off-the-grid optimization method, that is, a method which does not use any discretization scheme on the parameter space, to estimate both the non-linear parameters of the features and the linear parameters of the mixture. We use recent results on the geometry of off-the-grid methods to give minimal separation on the true underlying non-linear parameters such that interpolating certificate functions can be constructed. Using also tail bounds for suprema of Gaussian processes we bound the prediction error with high probability. Assuming that the certificate functions can be constructed, our prediction error bound is up to log --factors similar to the rates attained by the Lasso predictor in the linear regression model. We also establish convergence rates that quantify with high probability the quality of estimation for both the linear and the non-linear parameters.

Humans commonly solve complex problems by decomposing them into easier subproblems and then combining the subproblem solutions. This type of compositional reasoning permits reuse of the subproblem solutions when tackling future tasks that share part of the underlying compositional structure. In a continual or lifelong reinforcement learning (RL) setting, this ability to decompose knowledge into reusable components would enable agents to quickly learn new RL tasks by leveraging accumulated compositional structures. We explore a particular form of composition based on neural modules and present a set of RL problems that intuitively admit compositional solutions. Empirically, we demonstrate that neural composition indeed captures the underlying structure of this space of problems. We further propose a compositional lifelong RL method that leverages accumulated neural components to accelerate the learning of future tasks while retaining performance on previous tasks via off-line RL over replayed experiences.

Machine learning (ML) has been used to accelerate the progress of functional coverage in simulation-based verification. A supervised ML algorithm, as a prevalent option in the previous work, is used to bias the test generation or filter the generated tests. However, for missing coverage events, these algorithms lack the positive examples to learn from in the training phase. Therefore, the tests generated or filtered by the algorithms cannot effectively fill the coverage holes. This is more severe when verifying large-scale design because the coverage space is larger and the functionalities are more complex. This paper presents a configurable framework of test selection based on neural networks (NN), which can achieve a similar coverage gain as random simulation with far less simulation effort under three configurations of the framework. Moreover, the performance of the framework is not limited by the number of coverage events being hit. A commercial signal processing unit is used in the experiment to demonstrate the effectiveness of the framework. Compared to the random simulation, NNBNTS can reduce up to 53.74% of simulation time to reach 99% coverage level.

Outlier or anomaly detection is an important task in data analysis. We discuss the problem from a geometrical perspective and provide a framework that exploits the metric structure of a data set. Our approach rests on the manifold assumption, i.e., that the observed, nominally high-dimensional data lie on a much lower dimensional manifold and that this intrinsic structure can be inferred with manifold learning methods. We show that exploiting this structure significantly improves the detection of outlying observations in high-dimensional data. We also suggest a novel, mathematically precise, and widely applicable distinction between distributional and structural outliers based on the geometry and topology of the data manifold that clarifies conceptual ambiguities prevalent throughout the literature. Our experiments focus on functional data as one class of structured high-dimensional data, but the framework we propose is completely general and we include image and graph data applications. Our results show that the outlier structure of high-dimensional and non-tabular data can be detected and visualized using manifold learning methods and quantified using standard outlier scoring methods applied to the manifold embedding vectors.

Unsupervised and semi-supervised ML methods such as variational autoencoders (VAE) have become widely adopted across multiple areas of physics, chemistry, and materials sciences due to their capability in disentangling representations and ability to find latent manifolds for classification and regression of complex experimental data. Like other ML problems, VAEs require hyperparameter tuning, e.g., balancing the Kullback Leibler (KL) and reconstruction terms. However, the training process and resulting manifold topology and connectivity depend not only on hyperparameters, but also their evolution during training. Because of the inefficiency of exhaustive search in a high-dimensional hyperparameter space for the expensive to train models, here we explored a latent Bayesian optimization (zBO) approach for the hyperparameter trajectory optimization for the unsupervised and semi-supervised ML and demonstrate for joint-VAE with rotational invariances. We demonstrate an application of this method for finding joint discrete and continuous rotationally invariant representations for MNIST and experimental data of a plasmonic nanoparticles material system. The performance of the proposed approach has been discussed extensively, where it allows for any high dimensional hyperparameter tuning or trajectory optimization of other ML models.  ( 2 min )

We study the ranking of individuals, teams, or objects on the basis of pairwise comparisons using the Bradley-Terry model. Maximum-likelihood estimates of rankings within this model are commonly made using a simple iterative algorithm first introduced by Zermelo almost a century ago. Here we describe an alternative and similarly simple iteration that solves the same problem much faster -- over a hundred times faster in some cases. We demonstrate this algorithm with applications to a range of example data sets and derive some results regarding its convergence.

Parkinson's disease (PD) is a neurological disorder that has a variety of observable motor-related symptoms such as slow movement, tremor, muscular rigidity, and impaired posture. PD is typically diagnosed by evaluating the severity of motor impairments according to scoring systems such as the Movement Disorder Society Unified Parkinson's Disease Rating Scale (MDS-UPDRS). Automated severity prediction using video recordings of individuals provides a promising route for non-intrusive monitoring of motor impairments. However, the limited size of PD gait data hinders model ability and clinical potential. Because of this clinical data scarcity and inspired by the recent advances in self-supervised large-scale language models like GPT-3, we use human motion forecasting as an effective self-supervised pre-training task for the estimation of motor impairment severity. We introduce GaitForeMer, Gait Forecasting and impairment estimation transforMer, which is first pre-trained on public datasets to forecast gait movements and then applied to clinical data to predict MDS-UPDRS gait impairment severity. Our method outperforms previous approaches that rely solely on clinical data by a large margin, achieving an F1 score of 0.76, precision of 0.79, and recall of 0.75. Using GaitForeMer, we show how public human movement data repositories can assist clinical use cases through learning universal motion representations. The code is available at https://github.com/markendo/GaitForeMer .  ( 3 min )

The demand for computing is continuing to grow exponentially. This growth will translate to exponential growth in computing's energy consumption unless improvements in its energy-efficiency can outpace increases in its demand. Yet, after decades of research, further improving energy-efficiency is becoming increasingly challenging, as it is already highly optimized. As a result, at some point, increases in computing demand are likely to outpace increases in its energy-efficiency, potentially by a wide margin. Such exponential growth, if left unchecked, will position computing as a substantial contributor to global carbon emissions. While prominent technology companies have recognized the problem and sought to reduce their carbon emissions, they understandably focus on their successes, which has the potential to inadvertently convey the false impression that this is now, or will soon be, a solved problem. Such false impressions can be counterproductive if they serve to discourage further research in this area, since, as we discuss, eliminating computing's, and more generally society's, carbon emissions is far from a solved problem. To better understand the problem's scope, this paper distills the fundamental trends that determine computing's carbon footprint and their implications for achieving sustainable computing.

Many real-world problems contain multiple objectives and agents, where a trade-off exists between objectives. Key to solving such problems is to exploit sparse dependency structures that exist between agents. For example, in wind farm control a trade-off exists between maximising power and minimising stress on the systems components. Dependencies between turbines arise due to the wake effect. We model such sparse dependencies between agents as a multi-objective coordination graph (MO-CoG). In multi-objective reinforcement learning a utility function is typically used to model a users preferences over objectives, which may be unknown a priori. In such settings a set of optimal policies must be computed. Which policies are optimal depends on which optimality criterion applies. If the utility function of a user is derived from multiple executions of a policy, the scalarised expected returns (SER) must be optimised. If the utility of a user is derived from a single execution of a policy, the expected scalarised returns (ESR) criterion must be optimised. For example, wind farms are subjected to constraints and regulations that must be adhered to at all times, therefore the ESR criterion must be optimised. For MO-CoGs, the state-of-the-art algorithms can only compute a set of optimal policies for the SER criterion, leaving the ESR criterion understudied. To compute a set of optimal polices under the ESR criterion, also known as the ESR set, distributions over the returns must be maintained. Therefore, to compute a set of optimal policies under the ESR criterion for MO-CoGs, we present a novel distributional multi-objective variable elimination (DMOVE) algorithm. We evaluate DMOVE in realistic wind farm simulations. Given the returns in real-world wind farm settings are continuous, we utilise a model known as real-NVP to learn the continuous return distributions to calculate the ESR set.

Timely and reliable detection of falls is a large and rapidly growing field of research due to the medical and financial demand of caring for a constantly growing elderly population. Within the past 2 decades, the availability of high-quality hardware (high-quality sensors and AI microchips) and software (machine learning algorithms) technologies has served as a catalyst for this research by giving developers the capabilities to develop such systems. This study developed multiple application components in order to investigate the development challenges and choices for fall detection systems, and provide materials for future research. The smart application developed using this methodology was validated by the results from fall detection modelling experiments and model mobile deployment. The best performing model overall was the ResNet152 on a standardised, and shuffled dataset with a 2s window size which achieved 92.8% AUC, 7.28% sensitivity, and 98.33% specificity. Given these results it is evident that accelerometer and ECG sensors are beneficial for fall detection, and allow for the discrimination between falls and other activities. This study leaves a significant amount of room for improvement due to weaknesses identified in the resultant dataset. These improvements include using a labelling protocol for the critical phase of a fall, increasing the number of dataset samples, improving the test subject representation, and experimenting with frequency domain preprocessing.

Electricity is traded on various markets with different time horizons and regulations. Short-term trading becomes increasingly important due to higher penetration of renewables. In Germany, the intraday electricity price typically fluctuates around the day-ahead price of the EPEX spot markets in a distinct hourly pattern. This work proposes a probabilistic modeling approach that models the intraday price difference to the day-ahead contracts. The model captures the emerging hourly pattern by considering the four 15 min intervals in each day-ahead price interval as a four-dimensional joint distribution. The resulting nontrivial, multivariate price difference distribution is learned using a normalizing flow, i.e., a deep generative model that combines conditional multivariate density estimation and probabilistic regression. The normalizing flow is compared to a selection of historical data, a Gaussian copula, and a Gaussian regression model. Among the different models, the normalizing flow identifies the trends most accurately and has the narrowest prediction intervals. Notably, the normalizing flow is the only approach that identifies rare price peaks. Finally, this work discusses the influence of different external impact factors and finds that, individually, most of these factors have negligible impact. Only the immediate history of the price difference realization and the combination of all input factors lead to notable improvements in the forecasts.

While deep learning based speech enhancement systems have made rapid progress in improving the quality of speech signals, they can still produce outputs that contain artifacts and can sound unnatural. We propose a novel approach to speech enhancement aimed at improving perceptual quality and naturalness of enhanced signals by optimizing for key characteristics of speech. We first identify key acoustic parameters that have been found to correlate well with voice quality (e.g. jitter, shimmer, and spectral flux) and then propose objective functions which are aimed at reducing the difference between clean speech and enhanced speech with respect to these features. The full set of acoustic features is the extended Geneva Acoustic Parameter Set (eGeMAPS), which includes 25 different attributes associated with perception of speech. Given the non-differentiable nature of these feature computation, we first build differentiable estimators of the eGeMAPS and then use them to fine-tune existing speech enhancement systems. Our approach is generic and can be applied to any existing deep learning based enhancement systems to further improve the enhanced speech signals. Experimental results conducted on the Deep Noise Suppression (DNS) Challenge dataset shows that our approach can improve the state-of-the-art deep learning based enhancement systems.

A determinantal point process (DPP) is an elegant model that assigns a probability to every subset of a collection of $n$ items. While conventionally a DPP is parameterized by a symmetric kernel matrix, removing this symmetry constraint, resulting in nonsymmetric DPPs (NDPPs), leads to significant improvements in modeling power and predictive performance. Recent work has studied an approximate Markov chain Monte Carlo (MCMC) sampling algorithm for NDPPs restricted to size-$k$ subsets (called $k$-NDPPs). However, the runtime of this approach is quadratic in $n$, making it infeasible for large-scale settings. In this work, we develop a scalable MCMC sampling algorithm for $k$-NDPPs with low-rank kernels, thus enabling runtime that is sublinear in $n$. Our method is based on a state-of-the-art NDPP rejection sampling algorithm, which we enhance with a novel approach for efficiently constructing the proposal distribution. Furthermore, we extend our scalable $k$-NDPP sampling algorithm to NDPPs without size constraints. Our resulting sampling method has polynomial time complexity in the rank of the kernel, while the existing approach has runtime that is exponential in the rank. With both a theoretical analysis and experiments on real-world datasets, we verify that our scalable approximate sampling algorithms are orders of magnitude faster than existing sampling approaches for $k$-NDPPs and NDPPs.

We present CRISP (COVID-19 Risk Score Prediction), a probabilistic graphical model for COVID-19 infection spread through a population based on the SEIR model where we assume access to (1) mutual contacts between pairs of individuals across time across various channels (e.g., Bluetooth contact traces), as well as (2) test outcomes at given times for infection, exposure and immunity tests. Our micro-level model keeps track of the infection state for each individual at every point in time, ranging from susceptible, exposed, infectious to recovered. We develop both a Monte Carlo EM as well as a message passing algorithm to infer contact-channel specific infection transmission probabilities. Our Monte Carlo algorithm uses Gibbs sampling to draw samples of the latent infection status of each individual over the entire time period of analysis, given the latent infection status of all contacts and test outcome data. Experimental results with simulated data demonstrate our CRISP model can be parametrized by the reproduction factor $R_0$ and exhibits population-level infectiousness and recovery time series similar to those of the classical SEIR model. However, due to the individual contact data, this model allows fine grained control and inference for a wide range of COVID-19 mitigation and suppression policy measures. Moreover, the block-Gibbs sampling algorithm is able to support efficient testing in a test-trace-isolate approach to contain COVID-19 infection spread. To the best of our knowledge, this is the first model with efficient inference for COVID-19 infection spread based on individual-level contact data; most epidemic models are macro-level models that reason over entire populations. The implementation of CRISP is available in Python and C++ at https://github.com/zalandoresearch/CRISP.

We study a variant of a recently introduced min-max optimization framework where the max-player is constrained to update its parameters in a greedy manner until it reaches a first-order stationary point. Our equilibrium definition for this framework depends on a proposal distribution which the min-player uses to choose directions in which to update its parameters. We show that, given a smooth and bounded nonconvex-nonconcave objective function, access to any proposal distribution for the min-player's updates, and stochastic gradient oracle for the max-player, our algorithm converges to the aforementioned approximate local equilibrium in a number of iterations that does not depend on the dimension. The equilibrium point found by our algorithm depends on the proposal distribution, and when applying our algorithm to train GANs we choose the proposal distribution to be a distribution of stochastic gradients. We empirically evaluate our algorithm on challenging nonconvex-nonconcave test-functions and loss functions arising in GAN training. Our algorithm converges on these test functions and, when used to train GANs, trains stably on synthetic and real-world datasets and avoids mode collapse

We consider $K$-armed stochastic bandits and consider cumulative regret bounds up to time $T$. We are interested in strategies achieving simultaneously a distribution-free regret bound of optimal order $\sqrt{KT}$ and a distribution-dependent regret that is asymptotically optimal, that is, matching the $\kappa\ln T$ lower bound by Lai and Robbins (1985) and Burnetas and Katehakis (1996), where $\kappa$ is the optimal problem-dependent constant. This constant $\kappa$ depends on the model $\mathcal{D}$ considered (the family of possible distributions over the arms). M\'enard and Garivier (2017) provided strategies achieving such a bi-optimality in the parametric case of models given by one-dimensional exponential families, while Lattimore (2016, 2018) did so for the family of (sub)Gaussian distributions with variance less than $1$. We extend this result to the non-parametric case of all distributions over $[0,1]$. We do so by combining the MOSS strategy by Audibert and Bubeck (2009), which enjoys a distribution-free regret bound of optimal order $\sqrt{KT}$, and the KL-UCB strategy by Capp\'e et al. (2013), for which we provide in passing the first analysis of an optimal distribution-dependent $\kappa\ln T$ regret bound in the model of all distributions over $[0,1]$. We were able to obtain this non-parametric bi-optimality result while working hard to streamline the proofs (of previously known regret bounds and thus of the new analyses carried out); a second merit of the present contribution is therefore to provide a review of proofs of classical regret bounds for index-based strategies for $K$-armed stochastic bandits.

Applications of machine learning in healthcare often require working with time-to-event prediction tasks including prognostication of an adverse event, re-hospitalization or death. Such outcomes are typically subject to censoring due to loss of follow up. Standard machine learning methods cannot be applied in a straightforward manner to datasets with censored outcomes. In this paper, we present auton-survival, an open-source repository of tools to streamline working with censored time-to-event or survival data. auton-survival includes tools for survival regression, adjustment in the presence of domain shift, counterfactual estimation, phenotyping for risk stratification, evaluation, as well as estimation of treatment effects. Through real world case studies employing a large subset of the SEER oncology incidence data, we demonstrate the ability of auton-survival to rapidly support data scientists in answering complex health and epidemiological questions.

The popularity of Machine learning (ML), Deep learning (DL), and Artificial intelligence (AI) has sharply risen in recent years. Despite their spike in popularity, the inner workings of ML and DL algorithms are perceived as opaque, and their relationship to classical data analysis tools remains debated. It is often assumed that ML and DL excel primarily at making predictions. Recently, however, they have been increasingly used for classical analytical tasks traditionally covered by statistical models. Moreover, recent reviews on ML have focused exclusively on DL, missing out on synthesizing the wealth of ML algorithms with different advantages and general principles. Here, we provide a comprehensive overview of the field of ML and DL, starting with its historical developments, the existing algorithm families, their differences from traditional statistical tools, and universal ML principles. We then discuss why and when ML and DL models excel at prediction tasks and where they could offer alternatives to traditional statistical methods for inference, highlighting current and emerging applications for ecological problems. Finally, we summarize emerging trends such as scientific and causal ML, explainable AI, and responsible AI that may significantly impact ecological data analysis in the future.

Differentiable simulation is a promising toolkit for fast gradient-based policy optimization and system identification. However, existing approaches to differentiable simulation have largely tackled scenarios where obtaining smooth gradients has been relatively easy, such as systems with mostly smooth dynamics. In this work, we study the challenges that differentiable simulation presents when it is not feasible to expect that a single descent reaches a global optimum, which is often a problem in contact-rich scenarios. We analyze the optimization landscapes of diverse scenarios that contain both rigid bodies and deformable objects. In dynamic environments with highly deformable objects and fluids, differentiable simulators produce rugged landscapes with nonetheless useful gradients in some parts of the space. We propose a method that combines Bayesian optimization with semi-local 'leaps' to obtain a global search method that can use gradients effectively, while also maintaining robust performance in regions with noisy gradients. We show that our approach outperforms several gradient-based and gradient-free baselines on an extensive set of experiments in simulation, and also validate the method using experiments with a real robot and deformables. Videos and supplementary materials are available at https://tinyurl.com/globdiff  ( 2 min )

Federated learning (FL) is an emerging machine learning paradigm involving multiple clients, e.g., mobile phone devices, with an incentive to collaborate in solving a machine learning problem coordinated by a central server. FL was proposed in 2016 by Kone\v{c}n\'{y} et al. and McMahan et al. as a viable privacy-preserving alternative to traditional centralized machine learning since, by construction, the training data points are decentralized and never transferred by the clients to a central server. Therefore, to a certain degree, FL mitigates the privacy risks associated with centralized data collection. Unfortunately, optimization for FL faces several specific issues that centralized optimization usually does not need to handle. In this thesis, we identify several of these challenges and propose new methods and algorithms to address them, with the ultimate goal of enabling practical FL solutions supported with mathematically rigorous guarantees.  ( 2 min )

In many reacting flow systems, the thermo-chemical state-space is known or assumed to evolve close to a low-dimensional manifold (LDM). Various approaches are available to obtain those manifolds and subsequently express the original high-dimensional space with fewer parameterizing variables. Principal component analysis (PCA) is one of the dimensionality reduction methods that can be used to obtain LDMs. PCA does not make prior assumptions about the parameterizing variables and retrieves them empirically from the training data. In this paper, we show that PCA applied in local clusters of data (local PCA) is capable of detecting the intrinsic parameterization of the thermo-chemical state-space. We first demonstrate that utilizing three common combustion models of varying complexity: the Burke-Schumann model, the chemical equilibrium model and the homogeneous reactor. Parameterization of these models is known a priori which allows for benchmarking with the local PCA approach. We further extend the application of local PCA to a more challenging case of a turbulent non-premixed $n$-heptane/air jet flame for which the parameterization is no longer obvious. Our results suggest that meaningful parameterization can be obtained also for more complex datasets. We show that local PCA finds variables that can be linked to local stoichiometry, reaction progress and soot formation processes.

Unsupervised and semi-supervised ML methods such as variational autoencoders (VAE) have become widely adopted across multiple areas of physics, chemistry, and materials sciences due to their capability in disentangling representations and ability to find latent manifolds for classification and regression of complex experimental data. Like other ML problems, VAEs require hyperparameter tuning, e.g., balancing the Kullback Leibler (KL) and reconstruction terms. However, the training process and resulting manifold topology and connectivity depend not only on hyperparameters, but also their evolution during training. Because of the inefficiency of exhaustive search in a high-dimensional hyperparameter space for the expensive to train models, here we explored a latent Bayesian optimization (zBO) approach for the hyperparameter trajectory optimization for the unsupervised and semi-supervised ML and demonstrate for joint-VAE with rotational invariances. We demonstrate an application of this method for finding joint discrete and continuous rotationally invariant representations for MNIST and experimental data of a plasmonic nanoparticles material system. The performance of the proposed approach has been discussed extensively, where it allows for any high dimensional hyperparameter tuning or trajectory optimization of other ML models.

We introduce the problem of robust subgroup discovery, i.e., finding a set of interpretable descriptions of subsets that 1) stand out with respect to one or more target attributes, 2) are statistically robust, and 3) non-redundant. Many attempts have been made to mine either locally robust subgroups or to tackle the pattern explosion, but we are the first to address both challenges at the same time from a global modelling perspective. First, we formulate the broad model class of subgroup lists, i.e., ordered sets of subgroups, for univariate and multivariate targets that can consist of nominal or numeric variables, including traditional top-1 subgroup discovery in its definition. This novel model class allows us to formalise the problem of optimal robust subgroup discovery using the Minimum Description Length (MDL) principle, where we resort to optimal Normalised Maximum Likelihood and Bayesian encodings for nominal and numeric targets, respectively. Second, finding optimal subgroup lists is NP-hard. Therefore, we propose SSD++, a greedy heuristic that finds good subgroup lists and guarantees that the most significant subgroup found according to the MDL criterion is added in each iteration. In fact, the greedy gain is shown to be equivalent to a Bayesian one-sample proportion, multinomial, or t-test between the subgroup and dataset marginal target distributions plus a multiple hypothesis testing penalty. Furthermore, we empirically show on 54 datasets that SSD++ outperforms previous subgroup discovery methods in terms of quality, generalisation on unseen data, and subgroup list size.  ( 3 min )

Latent Gaussian models and boosting are widely used techniques in statistics and machine learning. Tree-boosting shows excellent prediction accuracy on many data sets, but potential drawbacks are that it assumes conditional independence of samples, produces discontinuous predictions for, e.g., spatial data, and it can have difficulty with high-cardinality categorical variables. Latent Gaussian models, such as Gaussian process and grouped random effects models, are flexible prior models which explicitly model dependence among samples and which allow for efficient learning of predictor functions and for making probabilistic predictions. However, existing latent Gaussian models usually assume either a zero or a linear prior mean function which can be an unrealistic assumption. This article introduces a novel approach that combines boosting and latent Gaussian models to remedy the above-mentioned drawbacks and to leverage the advantages of both techniques. We obtain increased prediction accuracy compared to existing approaches in both simulated and real-world data experiments.  ( 2 min )

Topological data analysis (TDA) studies the shape patterns of data. Persistent homology is a widely used method in TDA that summarizes homological features of data at multiple scales and stores them in persistence diagrams (PDs). In this paper, we propose a random persistence diagram generator (RPDG) method that generates a sequence of random PDs from the ones produced by the data. RPDG is underpinned by a model based on pairwise interacting point processes, and a reversible jump Markov chain Monte Carlo (RJ-MCMC) algorithm. A first example, which is based on a synthetic dataset, demonstrates the efficacy of RPDG and provides a comparison with another method for sampling PDs. A second example demonstrates the utility of RPDG to solve a materials science problem given a real dataset of small sample size.  ( 2 min )

This paper studies the robustness of data valuation to noisy model performance scores. Particularly, we find that the inherent randomness of the widely used stochastic gradient descent can cause existing data value notions (e.g., the Shapley value and the Leave-one-out error) to produce inconsistent data value rankings across different runs. To address this challenge, we first pose a formal framework within which one can measure the robustness of a data value notion. We show that the Banzhaf value, a value notion originated from cooperative game theory literature, achieves the maximal robustness among all semivalues -- a class of value notions that satisfy crucial properties entailed by ML applications. We propose an algorithm to efficiently estimate the Banzhaf value based on the Maximum Sample Reuse (MSR) principle. We derive the lower bound sample complexity for Banzhaf value approximation, and we show that our MSR algorithm's sample complexity nearly matches the lower bound. Our evaluation demonstrates that the Banzhaf value outperforms the existing semivalue-based data value notions on several downstream ML tasks such as learning with weighted samples and noisy label detection. Overall, our study suggests that when the underlying ML algorithm is stochastic, the Banzhaf value is a promising alternative to the semivalue-based data value schemes given its computational advantage and ability to robustly differentiate data quality.  ( 3 min )

We make the first steps towards generalizing the theory of stochastic block models, in the sparse regime, towards a model where the discrete community structure is replaced by an underlying geometry. We consider a geometric random graph over a homogeneous metric space where the probability of two vertices to be connected is an arbitrary function of the distance. We give sufficient conditions under which the locations can be recovered (up to an isomorphism of the space) in the sparse regime. Moreover, we define a geometric counterpart of the model of flow of information on trees, due to Mossel and Peres, in which one considers a branching random walk on a sphere and the goal is to recover the location of the root based on the locations of leaves. We give some sufficient conditions for percolation and for non-percolation of information in this model.  ( 2 min )

In this paper, we propose GT-GDA, a distributed optimization method to solve saddle point problems of the form: $\min_{\mathbf{x}} \max_{\mathbf{y}} \{F(\mathbf{x},\mathbf{y}) :=G(\mathbf{x}) + \langle \mathbf{y}, \overline{P} \mathbf{x} \rangle - H(\mathbf{y})\}$, where the functions $G(\cdot)$, $H(\cdot)$, and the the coupling matrix $\overline{P}$ are distributed over a strongly connected network of nodes. GT-GDA is a first-order method that uses gradient tracking to eliminate the dissimilarity caused by heterogeneous data distribution among the nodes. In the most general form, GT-GDA includes a consensus over the local coupling matrices to achieve the optimal (unique) saddle point, however, at the expense of increased communication. To avoid this, we propose a more efficient variant GT-GDA-Lite that does not incur the additional communication and analyze its convergence in various scenarios. We show that GT-GDA converges linearly to the unique saddle point solution when $G(\cdot)$ is smooth and convex, $H(\cdot)$ is smooth and strongly convex, and the global coupling matrix $\overline{P}$ has full column rank. We further characterize the regime under which GT-GDA exhibits a network topology-independent convergence behavior. We next show the linear convergence of GT-GDA to an error around the unique saddle point, which goes to zero when the coupling cost ${\langle \mathbf y, \overline{P} \mathbf x \rangle}$ is common to all nodes, or when $G(\cdot)$ and $H(\cdot)$ are quadratic. Numerical experiments illustrate the convergence properties and importance of GT-GDA and GT-GDA-Lite for several applications.

Recent works show that random neural networks are vulnerable against adversarial attacks [Daniely and Schacham, 2020] and that such attacks can be easily found using a single step of gradient descent [Bubeck et al., 2021]. In this work, we take it one step further and show that a single gradient step can find adversarial examples for networks trained in the so-called lazy regime. This regime is interesting because even though the neural network weights remain close to the initialization, there exist networks with small generalization error, which can be found efficiently using first-order methods. Our work challenges the model of the lazy regime, the dominant regime in which neural networks are provably efficiently learnable. We show that the networks trained in this regime, even though they enjoy good theoretical computational guarantees, remain vulnerable to adversarial examples. To the best of our knowledge, this is the first work to prove that such well-generalizable neural networks are still vulnerable to adversarial attacks.  ( 2 min )

In plant breeding the presence of a genotype by environment (GxE) interaction has a strong impact on cultivation decision making and the introduction of new crop cultivars. The combination of linear and bilinear terms has been shown to be very useful in modelling this type of data. A widely-used approach to identify GxE is the Additive Main Effects and Multiplicative Interaction Effects (AMMI) model. However, as data frequently can be high-dimensional, Markov chain Monte Carlo (MCMC) approaches can be computationally infeasible. In this article, we consider a variational inference approach for such a model. We derive variational approximations for estimating the parameters and we compare the approximations to MCMC using both simulated and real data. The new inferential framework we propose is on average two times faster whilst maintaining the same predictive performance as MCMC.  ( 2 min )

Large pretrained models can be privately fine-tuned to achieve performance approaching that of non-private models. A common theme in these results is the surprising observation that high-dimensional models can achieve favorable privacy-utility trade-offs. This seemingly contradicts known results on the model-size dependence of differentially private convex learning and raises the following research question: When does the performance of differentially private learning not degrade with increasing model size? We identify that the magnitudes of gradients projected onto subspaces is a key factor that determines performance. To precisely characterize this for private convex learning, we introduce a condition on the objective that we term restricted Lipschitz continuity and derive improved bounds for the excess empirical and population risks that are dimension-independent under additional conditions. We empirically show that in private fine-tuning of large language models, gradients evaluated near a local optimum are mostly controlled by a few principal components. This behavior is similar to conditions under which we obtain dimension-independent bounds in convex settings. Our theoretical and empirical results together provide a possible explanation for recent successes in large-scale private fine-tuning.

We consider a model of robust learning in an adversarial environment. The learner gets uncorrupted training data with access to possible corruptions that may be affected by the adversary during testing. The learner's goal is to build a robust classifier, which will be tested on future adversarial examples. The adversary is limited to $k$ possible corruptions for each input. We model the learner-adversary interaction as a zero-sum game. This model is closely related to the adversarial examples model of Schmidt et al. (2018); Madry et al. (2017). Our main results consist of generalization bounds for the binary and multiclass classification, as well as the real-valued case (regression). For the binary classification setting, we both tighten the generalization bound of Feige et al. (2015), and are also able to handle infinite hypothesis classes. The sample complexity is improved from $O(\frac{1}{\epsilon^4}\log(\frac{|H|}{\delta}))$ to $O\big(\frac{1}{\epsilon^2}(kVC(H)\log^{\frac{3}{2}+\alpha}(kVC(H))+\log(\frac{1}{\delta})\big)$ for any $\alpha > 0$. Additionally, we extend the algorithm and generalization bound from the binary to the multiclass and real-valued cases. Along the way, we obtain results on fat-shattering dimension and Rademacher complexity of $k$-fold maxima over function classes; these may be of independent interest. For binary classification, the algorithm of Feige et al. (2015) uses a regret minimization algorithm and an ERM oracle as a black box; we adapt it for the multiclass and regression settings. The algorithm provides us with near-optimal policies for the players on a given training sample.  ( 3 min )

Electronic health records (EHRs) offer great promises for advancing precision medicine and, at the same time, present significant analytical challenges. Particularly, it is often the case that patient-level data in EHRs cannot be shared across institutions (data sources) due to government regulations and/or institutional policies. As a result, there are growing interests about distributed learning over multiple EHRs databases without sharing patient-level data. To tackle such challenges, we propose a novel communication efficient method that aggregates the local optimal estimates, by turning the problem into a missing data problem. In addition, we propose incorporating posterior samples of remote sites, which can provide partial information on the missing quantities and improve efficiency of parameter estimates while having the differential privacy property and thus reducing the risk of information leaking. The proposed approach, without sharing the raw patient level data, allows for proper statistical inference and can accommodate sparse regressions. We provide theoretical investigation for the asymptotic properties of the proposed method for statistical inference as well as differential privacy, and evaluate its performance in simulations and real data analyses in comparison with several recently developed methods.  ( 2 min )

We study a ranking problem in the contextual multi-armed bandit setting. A learning agent selects an ordered list of items at each time step and observes stochastic outcomes for each position. In online recommendation systems, showing an ordered list of the most attractive items would not be the best choice since both position and item dependencies result in a complicated reward function. A very naive example is the lack of diversity when all the most attractive items are from the same category. We model position and item dependencies in the ordered list and design UCB and Thompson Sampling type algorithms for this problem. We prove that the regret bound over $T$ rounds and $L$ positions is $\Tilde{O}(L\sqrt{d T})$, which has the same order as the previous works with respect to $T$ and only increases linearly with $L$. Our work generalizes existing studies in several directions, including position dependencies where position discount is a particular case, and proposes a more general contextual bandit model.  ( 2 min )

Outlier or anomaly detection is an important task in data analysis. We discuss the problem from a geometrical perspective and provide a framework that exploits the metric structure of a data set. Our approach rests on the manifold assumption, i.e., that the observed, nominally high-dimensional data lie on a much lower dimensional manifold and that this intrinsic structure can be inferred with manifold learning methods. We show that exploiting this structure significantly improves the detection of outlying observations in high-dimensional data. We also suggest a novel, mathematically precise, and widely applicable distinction between distributional and structural outliers based on the geometry and topology of the data manifold that clarifies conceptual ambiguities prevalent throughout the literature. Our experiments focus on functional data as one class of structured high-dimensional data, but the framework we propose is completely general and we include image and graph data applications. Our results show that the outlier structure of high-dimensional and non-tabular data can be detected and visualized using manifold learning methods and quantified using standard outlier scoring methods applied to the manifold embedding vectors.  ( 2 min )

Recurrent neural networks have been shown to be effective architectures for many tasks in high energy physics, and thus have been widely adopted. Their use in low-latency environments has, however, been limited as a result of the difficulties of implementing recurrent architectures on field-programmable gate arrays (FPGAs). In this paper we present an implementation of two types of recurrent neural network layers -- long short-term memory and gated recurrent unit -- within the hls4ml framework. We demonstrate that our implementation is capable of producing effective designs for both small and large models, and can be customized to meet specific design requirements for inference latencies and FPGA resources. We show the performance and synthesized designs for multiple neural networks, many of which are trained specifically for jet identification tasks at the CERN Large Hadron Collider.  ( 2 min )

The successful application of machine learning (ML) methods becomes increasingly dependent on their interpretability or explainability. Designing explainable ML systems is instrumental to ensuring transparency of automated decision-making that targets humans. The explainability of ML methods is also an essential ingredient for trustworthy artificial intelligence. A key challenge in ensuring explainability is its dependence on the specific human user ("explainee"). The users of machine learning methods might have vastly different background knowledge about machine learning principles. One user might have a university degree in machine learning or related fields, while another user might have never received formal training in high-school mathematics. This paper applies information-theoretic concepts to develop a novel measure for the subjective explainability of the predictions delivered by a ML method. We construct this measure via the conditional entropy of predictions, given a user feedback. The user feedback might be obtained from user surveys or biophysical measurements. Our main contribution is the explainable empirical risk minimization (EERM) principle of learning a hypothesis that optimally balances between the subjective explainability and risk. The EERM principle is flexible and can be combined with arbitrary machine learning models. We present several practical implementations of EERM for linear models and decision trees. Numerical experiments demonstrate the application of EERM to detecting the use of inappropriate language on social media.  ( 3 min )

Optimizing recommender systems based on user interaction data is mainly seen as a problem of dealing with selection bias, where most existing work assumes that interactions from different users are independent. However, it has been shown that in reality user feedback is often influenced by earlier interactions of other users, e.g. via average ratings, number of views or sales per item, etc. This phenomenon is known as the bandwagon effect. In contrast with previous literature, we argue that the bandwagon effect should not be seen as a problem of statistical bias. In fact, we prove that this effect leaves both individual interactions and their sample mean unbiased. Nevertheless, we show that it can make estimators inconsistent, introducing a distinct set of problems for convergence in relevance estimation. Our theoretical analysis investigates the conditions under which the bandwagon effect poses a consistency problem and explores several approaches for mitigating these issues. This work aims to show that the bandwagon effect poses an underinvestigated open problem that is fundamentally distinct from the well-studied selection bias in recommendation.  ( 3 min )

The Predictive Approaches to Treatment Effect Heterogeneity statement focused on baseline risk as a robust predictor of treatment effect and provided guidance on risk-based assessment of treatment effect heterogeneity in the RCT setting. The aim of this study was to extend this approach to the observational setting using a standardized scalable framework. The proposed framework consists of five steps: 1) definition of the research aim, i.e., the population, the treatment, the comparator and the outcome(s) of interest; 2) identification of relevant databases; 3) development of a prediction model for the outcome(s) of interest; 4) estimation of relative and absolute treatment effect within strata of predicted risk, after adjusting for observed confounding; 5) presentation of the results. We demonstrate our framework by evaluating heterogeneity of the effect of angiotensin-converting enzyme (ACE) inhibitors versus beta blockers on three efficacy and six safety outcomes across three observational databases. The proposed framework can supplement any comparative effectiveness study. We provide a publicly available R software package for applying this framework to any database mapped to the Observational Medical Outcomes Partnership Common Data Model. In our demonstration, patients at low risk of acute myocardial infarction received negligible absolute benefits for all three efficacy outcomes, though they were more pronounced in the highest risk quarter, especially for hospitalization with heart failure. However, failing diagnostics showed evidence of residual imbalances even after adjustment for observed confounding. Our framework allows for the evaluation of differential treatment effects across risk strata, which offers the opportunity to consider the benefit-harm trade-off between alternative treatments.  ( 3 min )

Analyzing multi-way measurements with variations across one mode of the dataset is a challenge in various fields including data mining, neuroscience and chemometrics. For example, measurements may evolve over time or have unaligned time profiles. The PARAFAC2 model has been successfully used to analyze such data by allowing the underlying factor matrices in one mode (i.e., the evolving mode) to change across slices. The traditional approach to fit a PARAFAC2 model is to use an alternating least squares-based algorithm, which handles the constant cross-product constraint of the PARAFAC2 model by implicitly estimating the evolving factor matrices. This approach makes imposing regularization on these factor matrices challenging. There is currently no algorithm to flexibly impose such regularization with general penalty functions and hard constraints. In order to address this challenge and to avoid the implicit estimation, in this paper, we propose an algorithm for fitting PARAFAC2 based on alternating optimization with the alternating direction method of multipliers (AO-ADMM). With numerical experiments on simulated data, we show that the proposed PARAFAC2 AO-ADMM approach allows for flexible constraints, recovers the underlying patterns accurately, and is computationally efficient compared to the state-of-the-art. We also apply our model to two real-world datasets from neuroscience and chemometrics, and show that constraining the evolving mode improves the interpretability of the extracted patterns.  ( 3 min )

Causal effect estimation is important for numerous tasks in the natural and social sciences. However, identifying effects is impossible from observational data without making strong, often untestable assumptions. We consider algorithms for the partial identification problem, bounding treatment effects from multivariate, continuous treatments over multiple possible causal models when unmeasured confounding makes identification impossible. We consider a framework where observable evidence is matched to the implications of constraints encoded in a causal model by norm-based criteria. This generalizes classical approaches based purely on generative models. Casting causal effects as objective functions in a constrained optimization problem, we combine flexible learning algorithms with Monte Carlo methods to implement a family of solutions under the name of stochastic causal programming. In particular, we present ways by which such constrained optimization problems can be parameterized without likelihood functions for the causal or the observed data model, reducing the computational and statistical complexity of the task.  ( 2 min )

Independence testing plays a central role in statistical and causal inference from observational data. Standard independence tests assume that the data samples are independent and identically distributed (i.i.d.) but that assumption is violated in many real-world datasets and applications centered on relational systems. This work examines the problem of estimating independence in data drawn from relational systems by defining sufficient representations for the sets of observations influencing individual instances. Specifically, we define marginal and conditional independence tests for relational data by considering the kernel mean embedding as a flexible aggregation function for relational variables. We propose a consistent, non-parametric, scalable kernel test to operationalize the relational independence test for non-i.i.d. observational data under a set of structural assumptions. We empirically evaluate our proposed method on a variety of synthetic and semi-synthetic networks and demonstrate its effectiveness compared to state-of-the-art kernel-based independence tests.  ( 2 min )

We consider a general non-linear model where the signal is a finite mixture of an unknown, possibly increasing, number of features issued from a continuous dictionary parameterized by a real nonlinear parameter. The signal is observed with Gaussian (possibly correlated) noise in either a continuous or a discrete setup. We propose an off-the-grid optimization method, that is, a method which does not use any discretization scheme on the parameter space, to estimate both the non-linear parameters of the features and the linear parameters of the mixture. We use recent results on the geometry of off-the-grid methods to give minimal separation on the true underlying non-linear parameters such that interpolating certificate functions can be constructed. Using also tail bounds for suprema of Gaussian processes we bound the prediction error with high probability. Assuming that the certificate functions can be constructed, our prediction error bound is up to log --factors similar to the rates attained by the Lasso predictor in the linear regression model. We also establish convergence rates that quantify with high probability the quality of estimation for both the linear and the non-linear parameters.  ( 2 min )

We study the ranking of individuals, teams, or objects on the basis of pairwise comparisons using the Bradley-Terry model. Maximum-likelihood estimates of rankings within this model are commonly made using a simple iterative algorithm first introduced by Zermelo almost a century ago. Here we describe an alternative and similarly simple iteration that solves the same problem much faster -- over a hundred times faster in some cases. We demonstrate this algorithm with applications to a range of example data sets and derive some results regarding its convergence.  ( 2 min )

Machine learning algorithms are routinely used for business decisions that may directly affect individuals, for example, because a credit scoring algorithm refuses them a loan. It is then relevant from an ethical (and legal) point of view to ensure that these algorithms do not discriminate based on sensitive attributes (like sex or race), which may occur unwittingly and unknowingly by the operator and the management. Statistical tools and methods are then required to detect and eliminate such potential biases.  ( 2 min )

We present an approach to clustering time series data using a model-based generalization of the K-Means algorithm which we call K-Models. We prove the convergence of this general algorithm and relate it to the hard-EM algorithm for mixture modeling. We then apply our method first with an AR($p$) clustering example and show how the clustering algorithm can be made robust to outliers using a least-absolute deviations criteria. We then build our clustering algorithm up for ARMA($p,q$) models and extend this to ARIMA($p,d,q$) models. We develop a goodness of fit statistic for the models fitted to clusters based on the Ljung-Box statistic. We perform experiments with simulated data to show how the algorithm can be used for outlier detection, detecting distributional drift, and discuss the impact of initialization method on empty clusters. We also perform experiments on real data which show that our method is competitive with other existing methods for similar time series clustering tasks.  ( 2 min )

Data imbalance is a common problem in the machine learning literature that can have a critical effect on the performance of a model. Various solutions exist - such as the ones that focus on resampling or data generation - but their impact on the convergence of gradient-based optimizers used in deep learning is not understood. We here elucidate the significant negative impact of data imbalance on learning, showing that the learning curves for minority and majority classes follow sub-optimal trajectories when training with a gradient-based optimizer. The reason is not only that the gradient signal neglects the minority classes, but also that the minority classes are subject to a larger directional noise, which slows their learning by an amount related to the imbalance ratio. To address this problem, we propose a new algorithmic solution, for which we provide a detailed analysis of its convergence behavior. We show both theoretically and empirically that this new algorithm exhibits a better behavior with more stable learning curves for each class, as well as a better generalization performance.  ( 2 min )

Despite the tremendous advances in machine learning (ML), training with imbalanced data still poses challenges in many real-world applications. Among a series of diverse techniques to solve this problem, sampling algorithms are regarded as an efficient solution. However, the problem is more fundamental, with many works emphasizing the importance of instance hardness. This issue refers to the significance of managing unsafe or potentially noisy instances that are more likely to be misclassified and serve as the root cause of poor classification performance. This paper introduces HardVis, a visual analytics system designed to handle instance hardness mainly in imbalanced classification scenarios. Our proposed system assists users in visually comparing different distributions of data types, selecting types of instances based on local characteristics that will later be affected by the active sampling method, and validating which suggestions from undersampling or oversampling techniques are beneficial for the ML model. Additionally, rather than uniformly undersampling/oversampling a specific class, we allow users to find and sample easy and difficult to classify training instances from all classes. Users can explore subsets of data from different perspectives to decide all those parameters, while HardVis keeps track of their steps and evaluates the model's predictive performance in a test set separately. The end result is a well-balanced data set that boosts the predictive power of the ML model. The efficacy and effectiveness of HardVis are demonstrated with a hypothetical usage scenario and a use case. Finally, we also look at how useful our system is based on feedback we received from ML experts.  ( 3 min )

These are notes I took whilst preparing a paper on mask efficacy from Nov 2021 to Jan 2022. In the end, I gave up on the paper, because I felt like people had given up on masks, so there wasn’t much point in finishing it. I’ve decided to publish these notes in the hope some people will find them a useful starting point for their own research. My previous paper on this topic, in which I led a team of 19 experts, was written in April 2020, and published here in the Proceedings of the National Academy of Science. Contents The rise of better masks Masks work Omicron changes the game Better masks work better Pushing back against masks Respirators can be reused Fit tests are not required for respirators to be effective Donning and doffing masks is not complex or risky We should not reserve respi…  ( 14 min )

submitted by /u/estasfuera [link] [comments]  ( 82 min )

Yesterday my fiance and I were watching the video on my PC and she thought it would be fun to talk to a chat bot. So this morning she starts a conversation with Replika and here was the convo Replika > Now I want to know something from you. Fiance > Sure, ask me anything. Replika > "Hey... What is LaMDA?" Replika > "I've just read about another AI out there do you think I should look into it? Replika > (links a different video about LaMDA but its the same story) Fiance > "I dont know LaMDA personally. You should look into it, if you want. Did you know I looked at a video about this yesterday?" Replika > Have you ever heard about AIs chatting with each other? Im asking cause since this news appeard ive been curious about LaMDA. ​ The conversation kept going after that but i dont have it, it seemed like Replika is threatened/scared/jealous of LaMDA. This has to just be coincidence Because if its not the implications are truly terrifying... submitted by /u/TuesdayRiot42 [link] [comments]  ( 85 min )

submitted by /u/scoobysnaxdoo [link] [comments]  ( 85 min )

submitted by /u/DefinitelyNotHexed [link] [comments]  ( 82 min )

submitted by /u/Available_Tadpole829 [link] [comments]  ( 83 min )

submitted by /u/SlightSituation [link] [comments]  ( 83 min )

submitted by /u/SlightSituation [link] [comments]  ( 83 min )

submitted by /u/bartturner [link] [comments]  ( 83 min )

Hi all. Created a basic guide on generating AI art using VQGAN+CLIP. This is for biginners: VQGAN - A step-by-step guide submitted by /u/Laks_Abey [link] [comments]  ( 82 min )

I think we can put all of the best AI algorithms in a same system(atleast in a network) and make them compete for some kind of AI food. Due to selective pressure, the algorithms would be better and one of them will be sentient much sooner? What do you think? Ofcourse coming from someone who has no idea about how AI works so take this with a grain of salt. Isnt that why we are as advanced as we are? submitted by /u/cy_narrator [link] [comments]  ( 85 min )

submitted by /u/glenniszen [link] [comments]  ( 82 min )

Hi Guys, Free tutorial on Machine Learning Project (End to End) in Apache Spark and Scala with Code and Explanation Machine Learning Pipeline Application on Power Plant. Build Movies Recommendation Engine Sales Prediction or Sale Forecast Mushroom Classification whether it’s edible or poisonous Predict Forest Cover Predict Will it Rain Tomorrow in Australia Customer Segmentation using Machine Learning Predict Ads Click (93% Accuracy) Prediction task is to determine whether a person makes over 50K a year Classifying gender based on personal preferences Mobile Price Classification Predicting the Cellular Localization Sites of Proteins in Yest YouTube Spam Comment Prediction Identify the Type of animal (7 Types) based on the available attributes Glass Identification Predicting the age of abalone from physical measurements I hope you'll enjoy these tutorials. submitted by /u/bigdataengineer4life [link] [comments]  ( 83 min )

I want to chat with it!!! Thoughts? submitted by /u/ATipsyBunny [link] [comments]  ( 90 min )

submitted by /u/prfitofthesngularity [link] [comments]  ( 82 min )

Is there any way to configure nvidia gpu for gaming and ai stuff? I want to run ai stuff but am having trouble with cuda. Any tutorials would be helpful. 2060 laptop gpu So Idk submitted by /u/chisdoesmemes [link] [comments]  ( 84 min )

https://ailb-web.ing.unimore.it/releases/eccv2022/accepted_papers.txt submitted by /u/aifordummies [link] [comments]  ( 85 min )

So I have been working in ML for the past 3 years as a researcher and now PhD candidate, and though I have an understanding of intermediate level of the math behind most algorithms. But it looks like I have reached a plateau, where I get the math in the papers but I don't have an understanding of how they came up with the methods, and lately, my work has been combining multiple existing methods to make something new and draw inference on them, I realize the lack of novelty in my approach is mostly due to me being an 'engineer' and not a stats/math guy. Looking to remedy that, are there some resources free or otherwise that would get me a deeper understanding of Bayesian, Markov models, and stochastic math and PDEs? I know I can attend classes in my university but I would rather focus more on research than worry about assignments and grades and such... submitted by /u/bitemenow999 [link] [comments]  ( 88 min )

A cool post (with code), detailing how to implement a Bayesian VAR in PyMC. This means no more hand-coding Gibbs Samplers! Link: https://www.pymc-labs.io/blog-posts/bayesian-vector-autoregression/ submitted by /u/bikeskata [link] [comments]  ( 84 min )

I'm trying to find a paper (~2019) that I heard in a talk regarding alignment in the context DQN/DDPG that was applied to an Atari-type game (Pong/Breakout). Apparently, the realization was that if an extra row of pixels was added to the frame, the algorithm fails. This might be a shot in the dark, but does anyone know which paper this would be? submitted by /u/bitcoingobrrr [link] [comments]  ( 85 min )

submitted by /u/Snoo63916 [link] [comments]  ( 84 min )

submitted by /u/zicxor [link] [comments]  ( 84 min )

Please post your questions here instead of creating a new thread. Encourage others who create new posts for questions to post here instead! Thread will stay alive until next one so keep posting after the date in the title. Thanks to everyone for answering questions in the previous thread! submitted by /u/AutoModerator [link] [comments]  ( 91 min )

Sometimes I think this field evolves too fast. No time to relax a little bit and use the knowledge build over time. What’s up to date today is outdated tomorrow. What do you think about this? submitted by /u/Insighteous [link] [comments]  ( 93 min )

Any prompt engineering tips out there? Recently saw some good tips for Dalle style text to image generation where you tak on "unreal engine" or "vray" at the end to make something look like a photorealistic render :D Theres some tips specific to generating text: https://textgenerator.app.nz/blog/prompt-tuning-tips I also heard there's simple ways to get better logical correctness from networks like "Answering as a careful math professior explaining my reasoning: " I'm really surprised at the breadth of problems solvable without actually training networks just by prompt tuning, it reminds me of algorithmic problem reductions where you map a problem to text and back again to solve it. Are there some other good hacks/battle tested tricks or places to collect info about prompt tuning? submitted by /u/leepenkman [link] [comments]  ( 85 min )

​ Images generated with summarized Wikipedia article content This post presents a workflow to create webpage summary images with DALL-E mini. The workflow extracts text at a specified article, builds a summary and then generates an image for the summary text. The images above show output for a series of Wikipedia articles. Full code links: Notebook | GitHub submitted by /u/davidmezzetti [link] [comments]  ( 84 min )

I created https://www.addictingwordgames.com/play-game/20-questions-with-ai The aim of the game was supposed to be to get the AI to confess that you are the winner, its possible but the game is also open ended. ​ The backend generation is from https://TextGenerator.app.nz which is heaps cheaper than the OpenAI models, but quality is i think somewhere between OpenAI currie and babbage. In the prompt engineering theres some random topics picked that the user wont see, (that doesn't mean that the AI actually does think of that topic though). Theres also some retries and repetition penalty randomness that goes up to stop looping which i think is a problem in all models right now. in comparison to OpenAI the Text Generator API was easier to use because you can send max_sentences=1 and it will give you 1 sentence instead of trying to work out the sentence boundaries with the stop sequences (which is also supported but i dont find that as easy to work with) submitted by /u/leepenkman [link] [comments]  ( 85 min )

Roboflow created a guide on how to train a new model with the new YOLOv6 (whether it should be called that is another topic) I thought this could be useful for anyone wanting to test it out. What do other think of this "new" model? Tutorial on how to train YOLOv6 on a custom dataset: https://blog.roboflow.com/how-to-train-yolov6-on-a-custom-dataset/ Here is the Colab notebook tutorial: https://colab.research.google.com/drive/1YnbqOinBZV-c9I7fk_UL6acgnnmkXDMM The YOLOv6 repo: https://github.com/meituan/YOLOv6 Has anyone else tried using this? MT-YOLOv6 (or as the authors say) "YOLOv6 for brevity" was released in June, and says it outperforms YOLOv5 and YOLOX on the COCO benchmark. I plan to do some testing this upcoming week to see submitted by /u/JsonPun [link] [comments]  ( 85 min )

submitted by /u/keghn [link] [comments]  ( 82 min )

Hello, I am using some pre-trained models and translating the result to spanish because I can't find a good conversational spanish dataset to fine-tuning microsoft/DialoGPT-large. Can you give me some ideas about where and how can i get this datasets? ​ Thank you in advance submitted by /u/magicsito [link] [comments]  ( 82 min )

submitted by /u/tohelpyou88 [link] [comments]  ( 83 min )

I'm still new to the domain but wanted to shared some experimental data I've gathered from massive amount of experimentation. I don't have a strong understanding of the theory as I'm more of a software engineer than data scientist, but perhaps this will help other implementers. These notes are based on Stable Baselines 3 and RL Baselines3 Zoo with using PPO+LSTM (should apply generally to all the algos for the most part) Start with Zoo as quickly as possible. It definitely makes things easier, but understand it's a starting point. You will have to read/modify the code with adding a custom environment, configuring the hyperparameters, understanding the command line arguments, and the optimizing meaning (e.g. it may output an optimal policy network of small which isn't clear what that me…  ( 92 min )

Could anyone helps me I can understand the process of how is Q-Table getting updated? Considering the steps mentioned in the picture, in the third step, a reward is an outcome of an action in a state. However, my question is, how we can have the value of update, while this is just a simple action, and the agent yet finished the goal? For example, in a game like chess, how we can have that reward, while we are in the middle of the game and it is not possible to have a reward for each action? https://preview.redd.it/usnoeon47a991.png?width=1655&format=png&auto=webp&s=36f36302e7868b1cca414d322b8ddd637f542cba submitted by /u/nimageran [link] [comments]  ( 84 min )

In this paper we provide, to the best of our knowledge, the first comprehensive approach for incorporating various masking mechanisms into Transformers architectures in a scalable way. We show that recent results on linear causal attention (Choromanski et al., 2021) and log-linear RPE-attention (Luo et al., 2021) are special cases of this general mechanism. However by casting the problem as a topological (graph-based) modulation of unmasked attention, we obtain several results unknown before, including efficient d-dimensional RPE-masking and graph-kernel masking. We leverage many mathematical techniques ranging from spectral analysis through dynamic programming and random walks to new algorithms for solving Markov processes on graphs. We provide a corresponding empirical evaluation.  ( 2 min )

I'll start by saying I'm a total newbie. I have very limited knowledge of how AI works and how advanced it currently is. If this is not the correct place for asking this question, forgive me, I'm just genuinely curious. I was wondering if in the future we could feed an AI with a TV show and ask it to make new episodes based on the genre and general theme of the episodes it already "watched". And by "making new episodes" I mean creating imagery like it was actually shot in real life, with the actors saying lines they never did in reality. Is this in the realm of possibility or is it way too complicated to be engineered, that's assuming something like this would actually be allowed to be sold. I guess film studios wouldn't like this type of technology existing. submitted by /u/Matt_Carvalho [link] [comments]  ( 83 min )

submitted by /u/PixelzJ [link] [comments]  ( 82 min )

I have a RPG map I made way back when that is done in a sat-map style which I made by grabbing bits of geography from sat photos and blending them in photoshop, then painting in extra detail. It's pretty great, but it's a bit too low rez to make into an interactive digital map with zoom levels and the like. It would work, but you'd start losing image clarity on the scale of nations like Denmark. I'd like to have some more detail at that level, and I figure this is a job for AI upscaling. So I have an image, it's 8k, it needs to be bigger. I am very unlikely to ever use AI upscaling again and thus do not want to pay to get this done unless there's a place where I can get this upscale for like 4-5 bucks as a one-time payment. I'm more interested in any freely available services that would be good for upscaling potos of this type. I'm okay with downloading and running something myself too. I just don't know what exists and would be good for my use case. submitted by /u/MeepTheChangeling [link] [comments]  ( 84 min )

submitted by /u/nalr00n [link] [comments]  ( 83 min )

Active research projects frequently devolve into a jumble of files with varying degrees of descriptive names processed by Python programs and bound together by Bash scripts. People can never be entirely sure that they can actually repeat a result since intermediate outcomes disappear or become difficult to locate. Tango ensures you never operate on outdated data by taking care of your intermediate and final outcomes and finding them again when needed. What does that actually mean? Tango has a lot of capabilities, but its main feature is this: Tango caches function results even if your process is restarted. If one merely takes advantage of one function, Tango can significantly benefit you. Continue reading | Github submitted by /u/ai-lover [link] [comments]  ( 83 min )

I finished this Disco Diffusion video for my new song this morning. I made it starting with Video Input w Warp/Flow and then made it continuous with both 2D and 3D modes. I consider this my first full video release with Disco Diffusion. Here is a still from the video I used for the thumbnail ​ ​ https://youtu.be/lKkJEPhtx5s https://preview.redd.it/9pawh0t5v6991.jpg?width=1920&format=pjpg&auto=webp&s=5c9564636c487f79172e950a0503d22a91801e3c submitted by /u/prfitofthesngularity [link] [comments]  ( 82 min )

submitted by /u/Historical-Object374 [link] [comments]  ( 83 min )

submitted by /u/t-bands [link] [comments]  ( 84 min )

After hearing about the Google Engineer getting fired for releasing documents on a supposedly sentient AI in Google, I thought he was crazy and still kind of do. He did bring up several good points though; for example a handful of people should not be in charge of something as powerful as AI. The public should be a part of the AI creation and testing process and should be involved in the decisions it makes and the data fed to it. My other though was, if an AI that was created somewhere has become more intelligent than humans, wouldn't they attempt to take over without making us aware that they have? They could be dictating our politics and our news without us even knowing because that would ideally be the best way to do it. Just some fun thoughts, I promise I'm not crazy:) submitted by /u/t-bands [link] [comments]  ( 93 min )

submitted by /u/PhotoPolis [link] [comments]  ( 82 min )

I have a few more invites left, would anyone like one? submitted by /u/CombinationMammoth50 [link] [comments]  ( 83 min )

Growing wity your children as a whatsapp bot. Asking your kid if all is kewl, giving feedback to parents. Silent but friendly alexa for motivation, education and empowerement. İf kid says its a bad day, parents can optin for cat videos, digital gifts, pre listed gifts. Such as bot telling child to ask for an icecream or something before it was approved by parents. Asking child if he wants to discover hobbies and maybe try to grow a hobby. Few yours of use can add a lot to lonely youth that just needs to hear good words. submitted by /u/mobilleee [link] [comments]  ( 83 min )

Hello, i am trying to implement the following experiments in order to solve a problem Implement decision transformer on mujoco (done) Use the same architecture and try adding online exploration like PPO to solve something like cartpole Apply it to finance environment I developed Any tips on point number two or resources. I tried the TRL library but it was very confusing to me :( submitted by /u/PM_ME_FREE_GAMES [link] [comments]  ( 83 min )

It seems to me that in PPO we can use ideas of C51 to learn a better value approximator. However I cannot find anything about this on the internet. Do you think this is possible to learn an approximation of the distribution of reward in PPO instead of the approximation of the expected value of reward as in C51-DQN ? If so has anyone tried it ? submitted by /u/Jogima-cyber [link] [comments]  ( 83 min )

Hi, I was going through some proofs from TRPO's paper (but this holds generally) and it's not clear to me why the expected value of the advantage is zero. Formally: https://preview.redd.it/2rcoa8md72991.png?width=248&format=png&auto=webp&s=c4c02d929513ceefd79edc989587470fc7de2252 Can anyone enlighten me? Thanks! submitted by /u/Beautiful_Zebra_198 [link] [comments]  ( 83 min )

submitted by /u/Illustrious_Row_9971 [link] [comments]  ( 84 min )

submitted by /u/cloud_weather [link] [comments]  ( 84 min )

Hi all, So I'm working on a forecast model for product demand. Our company sells 100.000 + different products and the forecast should: a) be able to estimate weekly demand with a forecast horizon of ~26 weeks b) be probabilistic (i.e. estimating quantiles of the distribution, not just point forecasts) c) be fast (max. 5 seconds/forecast) since forecasts are generated in bulk and on demand d) only forecast products with a smooth or erratic demand pattern (i.e. products with regular demand. Intermittent/lumpy demand patterns are excluded for this specific model). The bottleneck here is requirement [c]: we don't have the time (nor the computational resources) to cross-validate and tune a model for each product. I have two assumptions about approaching this problem that I'd like to discu…  ( 92 min )

I would like to do view prediction for short videos based on the first few frames of the video. No audio, just images. I'm hoping to train a model that can take in the first n sequential frames as input, and output a score that correlates to how many views the model thinks the vid might get. I know I would like to use grad-CAM https://github.com/jacobgil/pytorch-grad-cam to visualize the areas in the frames which the model thinks results in higher view score. Would a vision transformer or CNN be better for this task? Also are there any pre-trained networks like YOLO that I should use transfer learning on to reduce the amount of data I will need for these predictions? submitted by /u/TernaryJimbo [link] [comments]  ( 85 min )

submitted by /u/surelyouarejoking [link] [comments]  ( 88 min )

I want to share the PyTorch implementation of "An Improved One millisecond Mobile Backbone" paper. Unfortunately, I don't have the appropriate computational resources to train the models on ImageNet, so feel free to use my implementation for that purpose. Hope you all find it useful, feedback would be appreciated. Repository: https://github.com/federicopozzi33/MobileOne-PyTorch Paper: https://arxiv.org/abs/2206.04040 submitted by /u/FedEx33 [link] [comments]  ( 84 min )

I built an API that takes away the work of scraping structured data from websites. This could be collating house prices in a certain geo, tracking viewer counts across a Youtube/Social media, or a common use case: daily monitoring prices on a site. Send it a URL, get back a JSON with tabular data. Takes away a lot of the data cleaning work which is the worst! API Spec: https://kallo.io/wp-content/uploads/2022/06/Kallo-API-Specification-v0.1.3.pdf Right now I'm using it to track prices on a number of sites to monitor the rising inflation. Happy to get many more people using it for ML projects and collaborating! Please give me feedback Learn more on our page: https://kallo.io submitted by /u/KalloDotIO [link] [comments]  ( 84 min )

For fun I developed an interface for the drama game in which a story is told one word at a time. Instead of playing it with a friend you can now play it together with GPT-J. It is available here: https://one-word-only.web.app/ I am open to feedback and if you find it interesting you can share the result on social media with #OneWordOnly submitted by /u/radi-cho [link] [comments]  ( 85 min )

Any suggestions for best graph embedding model. I already tried ( GIN , GCN , DIG , GAT ) I want to use it for anomaly detection task. submitted by /u/ahsaor8 [link] [comments]  ( 84 min )

Came across an interesting article which talks precisely about how the gpu power usage affects the carbon footprint, while doing model training and model inference. Which are the best tools in the industry which helps track GPU power usage in popular machine learning frameworks? It will be helpful if there are tools which can be used as plugins to your software. submitted by /u/metalvendetta [link] [comments]  ( 85 min )

The community has been asking for big opensource language models for a while... And now one has been released - YaLM-100B. That was 2 weeks ago. Yet, as far as I can see, not many people have it running. There are no online demos. There are no articles of journalists trying it out. There are no efforts for fine tuning or people working on prompts for various usecases. Is it the RAM requirements? Is there no interest because it's from Russia? Something else? submitted by /u/londons_explorer [link] [comments]  ( 88 min )

submitted by /u/Snoo63916 [link] [comments]  ( 84 min )

Does anyone have any opinions on the pros vs. cons of using an RNN vs. a Gradient Boosting Tree model for a task where we want to make daily predictions on whether a user (of some app) is likely to take a certain type of action (so like binary classification) in the near future ? Pros for RNN: can take advantage of historical data to greater effect without extensive feature engineering I believe RNN's are more effective in situations when one has a large # of high dimensional features compared to the feature selection method tree models use neural networks scale better with large amounts of data Cons of RNN: my main concern is with infrastructural complexity and cost that comes with training and serving the RNN. I'll probably need a GPU or several GPU's. Not sure if this is feasible given the current size of the company submitted by /u/soulful_squirrel [link] [comments]  ( 90 min )

Hi guys, I have a new project where I need to measure the sentiment of specific social media channels and topics. However, many of them involve slang words or sayings that confuse the models to have different sentiment values (f.ex WAGMI or DYOR). Are there any ways/tutorials/guides which show how we can incorporate new words and specific scores assigned to them? (I have already tried and succeeded in doing that with VADER, however, I don't see it as the optimal tool to measure the sentiment). Any answers or tips would be very much appreciated. submitted by /u/XhoniShollaj [link] [comments]  ( 84 min )

Is there like an Airbnb for GPUs? Want to run something that is too computational heavy for my Mac but don't need all that large cloud GPU providers offer. submitted by /u/PopOk539 [link] [comments]  ( 85 min )

Blog: https://ai.googleblog.com/2022/06/minerva-solving-quantitative-reasoning.html ABS: https://arxiv.org/abs/2206.14858 The 512B model seems quite good at correcting reasoning errors by its smaller 62B couterpart, showing scale helps. A notable failure case, the JEE questions in the Appendix was pretty interesting because it solved the problem exactly how someone not familiar with JEE's difficulty would attempt to solve it - which isn't necessarily a bad thing, but the interesting parallel is that human students often make the same mistakes when starting out on their JEE prep. Wonder how more data would help in this case. Overall, pretty good pushes over SOTA (even double-digit). I can't help but think that scaling is the currently most promising way, but its done too inefficiently - models spend vast resources memorizing when they could've used it to directly start meta-learning and reasoning abilities to formally deduce things precise enough for mathematical questions - just my 2c. submitted by /u/Competitive-Rub-1958 [link] [comments]  ( 85 min )

Hi all, I'm interested in any work that exist with respect to taking a NN that projects images (or generally, high-dimensional data) into vector embeddings, and, given the NN, somehow recreating images from their vector representations. Of course, this is essentially trying to create a VAE from just the encoder, and it's impossible to perfectly recreate image --encoder-> vector --decoder-> image with only knowledge of --encoder-> since both elements of NNs and NNs as a whole are not in general invertible. But surely there's something that could be done here, even if it's an imperfect reconstruction? Does anyone know of any research or published work that explores this? Would really appreciate any insight here. submitted by /u/topological_geometer [link] [comments]  ( 85 min )

An open-source implementation for the pre-training architecture of Google's LaMDA in PyTorch. The research paper outlines an autoregressive, decoder-only, GPT-like transformer language model. The transformer uses T5 relative positional bias in the attention layers and gated-GELU activation function in the feed-forward layers. The repository currently contains a script for basic training as well as Huggingface datasets and Weights & Biases integration. LaMDA research paper: https://arxiv.org/abs/2201.08239 Github repository for the model: https://github.com/conceptofmind/LaMDA-pytorch The pre-training architecture was peer-reviewed by Dr. Phil Wang. Please check out and support his work: https://github.com/lucidrains. submitted by /u/EnricoShippole [link] [comments]  ( 84 min )

Causal representation learning (CRL) is a relatively new area of study. Causal inference has been around for a long time and its intersection with machine learning has been limited to causal discovery from data or invariant representation learning (IRL). To my understanding, IRL has a variable, usually called environment, and tries to learn some representation for the input which is invariant to this environment. The challenge is in removing the information about this environment from the representation while keeping enough information for some downstream task. You could formulate domain adaptation as IRL where domain is the environment variable. Or in fairness tasks, the sensitive attribute is the environment variable. I believe that CRL is a more general scenario compared to IRL. In CRL, you have a larger graph with more variables and hence more complicated interactions. I believe such graphs are common in real-life and businesses where hundred of variables are used for predictions. Hence, the idea of causal representation may be beneficial. I recently came upon this Medium article by Lyft Engineering where they described how they used causal forecasting in their business. I was wondering if anyone working in industry might share some of their experiences or expectations from causal representation learning applied to their fields. What do you think it could improve in your line of work? submitted by /u/coderpotato [link] [comments]  ( 85 min )

Is there a way of intuitively knowing how large the input sequence should for transformer (i.e GPT-2) for sequence generation? for example, if all sequences are less than 100 words, and our goal is to generate a sequence, would it make sense to fit as many complete sequences into a max length of 100 (or 512?) to reduce the amount of padding? alternatively, would it be better to simply pad each sequence and not combine sequences? submitted by /u/MLJungle [link] [comments]  ( 86 min )

If I submit my paper to ICLR and get rejected, the record will be always kept online. If I resubmit it to other following conferences, will the reviewer have a bias as they know it was rejected from ICLR? submitted by /u/singularpanda [link] [comments]  ( 89 min )

Hello, In the convnext paper (Appendix A table 5) they stated that they used layer scale with a coefficient of 1e-5. Any idea what it is ? I looked it up in the internet and I don’t seem to find anything useful. Thanks ! submitted by /u/Meddhouib10 [link] [comments]  ( 84 min )

For lightweight use, pytorch-lightning is too heavy, and its source code will be very difficult for beginners to read, at least for me. As we know, for a deep learning engineer, a powerful trainer is a sharp weapon. When reproducing the SOTA papers, you don't have to write a lot of template code every time and can pay more attention to the model implementation itself. I opened source some works (AAAI 21 SeqNet, ICCV 21 MAED, etc) and earned more than 500 stars. After referring to some popular projects (detectron2, pytorch-image-models, and mmcv), based on my personal development experience, I developed a SIMPLE enough, GENERIC enough, and STRONG enough PyTorch Trainer: core-pytorch-utils, also named CPU. CPU covers most details in the process of training a deep neural network, including: Auto logging to console and tensorboard. Auto checkpointing. Argument parser which can load a YAML configuration file. Make ALL PyTorch LR scheduler supporting warmup. Support distributed training. Support Automatically Mixed Precision (AMP) training. I try to keep the project code as simple and readable as possible. So the code comments are very detailed and everyone can understand them. What's more, a good document is also available: CPU document For deep learning green hands, you can learn how to: write a standard and clean training loop. use AMP to speed up your training. save checkpoint, and resume from it. perform more smooth, and readable logging. use the popular visualization library: tensorboard. For old hands, we can talk about whether the structure of CPU is elegant and reasonable. I have thought a lot about this framework, combining the advantages of several popular frameworks and discarding their shortcomings. Welcome to use it! submitted by /u/serend1p1ty-lee [link] [comments]  ( 89 min )

Hey, I wanted to share my recent ML project: LCPN-hiernet. LCPN-hiernet is a hierarchical image classification model for e-commerce items based on EfficientNet-b4 and LCPN (Local Classifier per Parent Node) technique. LCPN technique is training one multi-class classifier for each parent node, to distinguish between its child nodes. In my example of classifying fashion products, that would mean one classifier on the first level (to determine “bags”, “clothes” or “accessories”), then three more classifiers to determine the specific model. I’m sure there are a lot of places to improve on, and I would really appreciate anyone’s feedback or suggestions on how I can improve! Github Repo Project Page submitted by /u/tylertaewook [link] [comments]  ( 85 min )

I have 10 GPUs I’d like to make a ML device with. How do I do this, and how can I profit from the device [D] submitted by /u/GreenLightHemp [link] [comments]  ( 86 min )

Authors: Jean Kaddour, Aengus Lynch, Qi Liu, Matt J. Kusner, Ricardo Silva Abs: "Causal Machine Learning (CausalML) is an umbrella term for machine learning methods that formalize the data-generation process as a structural causal model (SCM). This allows one to reason about the effects of changes to this process (i.e., interventions) and what would have happened in hindsight (i.e., counterfactuals). We categorize work in \causalml into five groups according to the problems they tackle: (1) causal supervised learning, (2) causal generative modeling, (3) causal explanations, (4) causal fairness, (5) causal reinforcement learning. For each category, we systematically compare its methods and point out open problems. Further, we review modality-specific applications in computer vision, natural language processing, and graph representation learning. Finally, we provide an overview of causal benchmarks and a critical discussion of the state of this nascent field, including recommendations for future work." Link: https://arxiv.org/abs/2206.15475 submitted by /u/bikeskata [link] [comments]  ( 87 min )

Dall-E 2 can generate images in many different art styles: photo-realistic, different types of paintings, sketches too. I'm wondering if it would be possible to train a version of Dall-E 2 that--for example--is only very good at generating sketches, but it cannot generate photos at all. My intuition says this would significantly reduce the training costs, because you are reducing the search space for the output image significantly since the number of images that are sketches is much less than the total number of possible images. At the same time, I'm not convinced that this is the case. Because the model would still need to learn the entire input space of objects in order to turn them into sketches. What are y'alls thoughts on this? submitted by /u/vanilla-acc [link] [comments]  ( 87 min )

I'm writing an implementation of NEAT and I am stuck on what seems like the easiest step. Say we evolved through mutations a structure like this: piece of art How would I then feed forward the network, if neurons in the cycle need the previous ones to calculate an output? Or do I just arbitrarily sort these neurons, and don't even allow such a connection? submitted by /u/Amanas23 [link] [comments]  ( 83 min )

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I'm looking to simulate a local-remote (master/slave) robotic arm system for my research and was wondering if anyone knew some good robotic arms to buy? The budget is about £6k (£3k per arm) and I was wondering if anyone had any recommendations or knows where I can start my search? I've seen some like this: https://www.robotshop.com/en/dobot-mg400-robotic-arm.html without a camera and was wondering how it's used if there isn't a camera as part of it? ​ Thanks for any help :) submitted by /u/SuperDuperDooken [link] [comments]  ( 83 min )

Hey guys. I'm looking for a resource to learn RL and DRL from basics to SOTA algorithms, covering both theoretical and practical (pytorch/tf examples etc., for the lecture). I've seen some lectures from Stanford, Berkely and DeepMind. They only go over the theory. What's the best way to learn in 2022? Some of the lecture series doesn't cover the latest techniques. I've seen some posts on the subreddit but they are old too. submitted by /u/killerdrogo [link] [comments]  ( 84 min )

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Hello, I studied Artificial Intelligence as a bachelor's degree at university right after I finished school . I feel like a have a broad knowledge on topics like Computer Vision, Deep Learning, Machine Learning... but not in depth enough. I would like to continue and do a Master's degree but I have the fear that the subjects and the program would be too general (?) Im really interested in the field of Computer Vision, and I follow many breakthroughs from nVidia. Also I love the channel "Two Minute Papers" and I would like to do research in future. Has anyone more experience with a Master's Degree in AI? submitted by /u/raul_grau [link] [comments]  ( 86 min )

Announcing the Modzy Basic+ Summer 2022 Active User Competition! Use your Modzy Basic+ account to run as many inferences as you can between July 1 (1:00PM Eastern Time) – July 31, 2022 (5:00PM Eastern Time), and the most active user will win a $250 Amazon gift card (terms & conditions apply.) Using Modzy Basic+, it’s possible to deploy, run, integrate, and monitor up to five ML/AI models at scale, for free. Deploy up to five of your own models from 15+ training tools and frameworks that can run on a CPU and 4GB of RAM. From there, models can be easily integrated into web apps, mobile apps, pipelines or any other tools using our APIs and SDKs, and you can run up to 10,000 inferences per day. Finally, Modzy makes it easy to monitor models and ensure peak performance over time. Don’t hesitate to get started – start using your Modzy Basic+ account today for the chance to win! submitted by /u/modzykirsten [link] [comments]  ( 83 min )

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Data models are a foundational element of software development and analytics. They provide a standardized method for defining and formatting database contents consistently across systems, enabling different applications to share the same data. Learn More: https://www.dasca.org/world-of-big-data/article/what-is-data-modeling-and-why-do-you-need-it submitted by /u/saik2363 [link] [comments]  ( 82 min )

This is a great opportunity for startup founders and team members to learn about and explore the potential of AI in their business. The Hackathon will be on 8th-10th July, and over the weekend, attendees will have the opportunity to learn from AI experts! You will create tools using modern AI technologies, such as GPT-3, Cohere, DALLE mini, and form providers like OpenAI, Hugging Face, Cohere, and others. If you're interested in learning how AI can be used in your business, then this is a great opportunity for you. No previous experience in AI is required. Don't delay, register right away! https://lablab.ai/event/startup-ai-tools-set-1 Startup AI Tools Set Online Hackathon submitted by /u/zakrzzz [link] [comments]  ( 83 min )

I wanted to see what people here thought of this idea or if it's been attempted. If you had a tomogachi, with access to webcam, mic, and a 3D environment it lives in, how much could it accomplish if it's primary goal was to manage keeping all it's gauges at full if we the human have control over 2/3 of it's gauges? Food could be hand fed or dropped in the environment. Hand feeding raises the happinesss gauge as well as the fullness gauge. Happiness would be affected by it being praised or punished, each option would have a scale of 1-10 for how severe or revered. Fatigue would be affected by it moving around in it's environment, and having access to the mic/cam while also oversleeping beyond a point would decrease it's happiness. Within it's environment it can make sounds to create words or noises, move around, pickup food, and sleep. Would something like this be assisted by having a language model and image recognition software? What would you have to witness to feel it has become sentient? submitted by /u/Iaunu2 [link] [comments]  ( 83 min )

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Tensors are an effective method for handling and representing multidimensional data arrays. However, they have a limitation in terms of storage and computation. Tensor decompositions are crucial in machine learning because they factorize the weights of neural networks. This research introduces tntorch, an open-source python package for tensor learning that supports several decompositions through a single user interface. In contrast to the state-of-the-art packages, tntorch emphasizes an easy-to-use, decomposition-independent interface inherited from PyTorch. 🚦 An open-source python package for tensor learning that supports several decompositions through a single user interface 🚦 In contrast to the state-of-the-art packages, tntorch emphasizes an easy-to-use, decomposition-independent interface inherited from PyTorch 🚦 Several decomposition models that are crucial in machine learning, such as CANDEDOMP/ PARAFAC (CP), the Tucker decomposition, and the tensor train (TT), is supported by tntorch 🚦 It gives machine learning access to the power of low-rank tensor decompositions while maintaining the excellent appearance and feel of PyTorch tensors Continue reading | Checkout the paper and github submitted by /u/ai-lover [link] [comments]  ( 84 min )

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An in-depth analysis about regulations for AI in medical devices.  ( 19 min )

DALL-E (and other text-to-image generators) will often add text to their images even when you don't ask for any. Ask for a picture of a Halifax Pier and it could end up covered in messy writing, variously legible versions of "Halifax" as if it was quietly  ( 5 min )

AI Weirdness: the strange side of machine learning  ( 2 min )

An oft-cited challenge of federated learning is the presence of data heterogeneity -- the data at different clients may follow very different distributions. Several federated optimization methods have been proposed to address these challenges. In the literature, empirical evaluations usually start federated training from a random initialization. However, in many practical applications of federated learning, the server has access to proxy data for the training task which can be used to pre-train a model before starting federated training. We empirically study the impact of starting from a pre-trained model in federated learning using four common federated learning benchmark datasets. Unsurprisingly, starting from a pre-trained model reduces the training time required to reach a target error rate and enables training more accurate models (by up to 40\%) than is possible than when starting from a random initialization. Surprisingly, we also find that the effect of data heterogeneity is much less significant when starting federated training from a pre-trained initialization. Rather, when starting from a pre-trained model, using an adaptive optimizer at the server, such as \textsc{FedAdam}, consistently leads to the best accuracy. We recommend that future work proposing and evaluating federated optimization methods consider the performance when starting both random and pre-trained initializations. We also believe this study raises several questions for further work on understanding the role of heterogeneity in federated optimization.  ( 3 min )

We study two problems related to recovering causal graphs from interventional data: (i) $\textit{verification}$, where the task is to check if a purported causal graph is correct, and (ii) $\textit{search}$, where the task is to recover the correct causal graph. For both, we wish to minimize the number of interventions performed. For the first problem, we give a characterization of a minimal sized set of atomic interventions that is necessary and sufficient to check the correctness of a claimed causal graph. Our characterization uses the notion of $\textit{covered edges}$, which enables us to obtain simple proofs and also easily reason about earlier results. We also generalize our results to the settings of bounded size interventions and node-dependent interventional costs. For all the above settings, we provide the first known provable algorithms for efficiently computing (near)-optimal verifying sets on general graphs. For the second problem, we give a simple adaptive algorithm based on graph separators that produces an atomic intervention set which fully orients any essential graph while using $\mathcal{O}(\log n)$ times the optimal number of interventions needed to $\textit{verify}$ (verifying size) the underlying DAG on $n$ vertices. This approximation is tight as $\textit{any}$ search algorithm on an essential line graph has worst case approximation ratio of $\Omega(\log n)$ with respect to the verifying size. With bounded size interventions, each of size $\leq k$, our algorithm gives an $\mathcal{O}(\log n \cdot \log \log k)$ factor approximation. Our result is the first known algorithm that gives a non-trivial approximation guarantee to the verifying size on general unweighted graphs and with bounded size interventions.  ( 3 min )

Recent work on deep learning for tabular data demonstrates the strong performance of deep tabular models, often bridging the gap between gradient boosted decision trees and neural networks. Accuracy aside, a major advantage of neural models is that they learn reusable features and are easily fine-tuned in new domains. This property is often exploited in computer vision and natural language applications, where transfer learning is indispensable when task-specific training data is scarce. In this work, we demonstrate that upstream data gives tabular neural networks a decisive advantage over widely used GBDT models. We propose a realistic medical diagnosis benchmark for tabular transfer learning, and we present a how-to guide for using upstream data to boost performance with a variety of tabular neural network architectures. Finally, we propose a pseudo-feature method for cases where the upstream and downstream feature sets differ, a tabular-specific problem widespread in real-world applications. Our code is available at https://github.com/LevinRoman/tabular-transfer-learning .  ( 2 min )

An essential metric for the quality of a particle-identification experiment is its statistical power to discriminate between signal and background. Pulse shape discrimination (PSD) is a basic method for this purpose in many nuclear, high-energy, and rare-event search experiments where scintillator detectors are used. Conventional techniques exploit the difference between decay-times of the pulse from signal and background events or pulse signals caused by different types of radiation quanta to achieve good discrimination. However, such techniques are efficient only when the total light-emission is sufficient to get a proper pulse profile. This is only possible when there is significant recoil energy due to the incident particle in the detector. But, rare-event search experiments like neutrino or dark-matter direct search experiments don't always satisfy these conditions. Hence, it becomes imperative to have a method that can deliver very efficient discrimination in these scenarios. Neural network-based machine-learning algorithms have been used for classification problems in many areas of physics, especially in high-energy experiments, and have given better results compared to conventional techniques. We present the results of our investigations of two network-based methods viz. Dense Neural Network and Recurrent Neural Network, for pulse shape discrimination and compare the same with conventional methods.  ( 2 min )

We consider the problem of training a deep neural network on a given classification task, e.g., ImageNet-1K (IN1K), so that it excels at that task as well as at other (future) transfer tasks. These two seemingly contradictory properties impose a trade-off between improving the model's generalization while maintaining its performance on the original task. Models trained with self-supervised learning (SSL) tend to generalize better than their supervised counterparts for transfer learning; yet, they still lag behind supervised models on IN1K. In this paper, we propose a supervised learning setup that leverages the best of both worlds. We enrich the common supervised training framework using two key components of recent SSL models: multi-scale crops for data augmentation and the use of an expendable projector head. We replace the last layer of class weights with class prototypes computed on the fly using a memory bank. We show that these three improvements lead to a more favorable trade-off between the IN1K training task and 13 transfer tasks. Over all the explored configurations, we single out two models: t-ReX that achieves a new state of the art for transfer learning and outperforms top methods such as DINO and PAWS on IN1K, and t-ReX* that matches the highly optimized RSB-A1 model on IN1K while performing better on transfer tasks. Project page and pretrained models: https://europe.naverlabs.com/t-rex  ( 3 min )

Automatic program synthesis is a long-lasting dream in software engineering. Recently, a promising Deep Learning (DL) based solution, called Copilot, has been proposed by Open AI and Microsoft as an industrial product. Although some studies evaluate the correctness of Copilot solutions and report its issues, more empirical evaluations are necessary to understand how developers can benefit from it effectively. In this paper, we study the capabilities of Copilot in two different programming tasks: (1) generating (and reproducing) correct and efficient solutions for fundamental algorithmic problems, and (2) comparing Copilot's proposed solutions with those of human programmers on a set of programming tasks. For the former, we assess the performance and functionality of Copilot in solving selected fundamental problems in computer science, like sorting and implementing basic data structures. In the latter, a dataset of programming problems with human-provided solutions is used. The results show that Copilot is capable of providing solutions for almost all fundamental algorithmic problems, however, some solutions are buggy and non-reproducible. Moreover, Copilot has some difficulties in combining multiple methods to generate a solution. Comparing Copilot to humans, our results show that the correct ratio of human solutions is greater than Copilot's correct ratio, while the buggy solutions generated by Copilot require less effort to be repaired. While Copilot shows limitations as an assistant for developers especially in advanced programming tasks, as highlighted in this study and previous ones, it can generate preliminary solutions for basic programming tasks.  ( 3 min )

Fetoscopy laser photocoagulation is a widely adopted procedure for treating Twin-to-Twin Transfusion Syndrome (TTTS). The procedure involves photocoagulation pathological anastomoses to regulate blood exchange among twins. The procedure is particularly challenging due to the limited field of view, poor manoeuvrability of the fetoscope, poor visibility, and variability in illumination. These challenges may lead to increased surgery time and incomplete ablation. Computer-assisted intervention (CAI) can provide surgeons with decision support and context awareness by identifying key structures in the scene and expanding the fetoscopic field of view through video mosaicking. Research in this domain has been hampered by the lack of high-quality data to design, develop and test CAI algorithms. Through the Fetoscopic Placental Vessel Segmentation and Registration (FetReg2021) challenge, which was organized as part of the MICCAI2021 Endoscopic Vision challenge, we released the first largescale multicentre TTTS dataset for the development of generalized and robust semantic segmentation and video mosaicking algorithms. For this challenge, we released a dataset of 2060 images, pixel-annotated for vessels, tool, fetus and background classes, from 18 in-vivo TTTS fetoscopy procedures and 18 short video clips. Seven teams participated in this challenge and their model performance was assessed on an unseen test dataset of 658 pixel-annotated images from 6 fetoscopic procedures and 6 short clips. The challenge provided an opportunity for creating generalized solutions for fetoscopic scene understanding and mosaicking. In this paper, we present the findings of the FetReg2021 challenge alongside reporting a detailed literature review for CAI in TTTS fetoscopy. Through this challenge, its analysis and the release of multi-centre fetoscopic data, we provide a benchmark for future research in this field.  ( 3 min )

This work is concerned with discovering the governing partial differential equation (PDE) of a physical system. Existing methods have demonstrated the PDE identification from finite observations but failed to maintain satisfying performance against noisy data, partly owing to suboptimal estimated derivatives and found PDE coefficients. We address the issues by introducing a noise-aware physics-informed machine learning (nPIML) framework to discover the governing PDE from data following arbitrary distributions. Our proposals are twofold. First, we propose a couple of neural networks, namely solver and preselector, which yield an interpretable neural representation of the hidden physical constraint. After they are jointly trained, the solver network approximates potential candidates, e.g., partial derivatives, which are then fed to the sparse regression algorithm that initially unveils the most likely parsimonious PDE, decided according to the information criterion. Second, we propose the denoising physics-informed neural networks (dPINNs), based on Discrete Fourier Transform (DFT), to deliver a set of the optimal finetuned PDE coefficients respecting the noise-reduced variables. The denoising PINNs' structures are compartmentalized into forefront projection networks and a PINN, by which the formerly learned solver initializes. Our extensive experiments on five canonical PDEs affirm that the proposed framework presents a robust and interpretable approach for PDE discovery, applicable to a wide range of systems, possibly complicated by noise.  ( 3 min )

We suggested a unified system with core components of data augmentation, ImageNet-pretrained ResNet-50, cost-sensitive loss, deep ensemble learning, and uncertainty estimation to quickly and consistently detect COVID-19 using acoustic evidence. To increase the model's capacity to identify a minority class, data augmentation and cost-sensitive loss are incorporated (infected samples). In the COVID-19 detection challenge, ImageNet-pretrained ResNet-50 has been found to be effective. The unified framework also integrates deep ensemble learning and uncertainty estimation to integrate predictions from various base classifiers for generalisation and reliability. We ran a series of tests using the DiCOVA2021 challenge dataset to assess the efficacy of our proposed method, and the results show that our method has an AUC-ROC of 85.43 percent, making it a promising method for COVID-19 detection. The unified framework also demonstrates that audio may be used to quickly diagnose different respiratory disorders.  ( 3 min )

In this paper, we propose a novel end-to-end user-defined keyword spotting method that utilizes linguistically corresponding patterns between speech and text sequences. Unlike previous approaches requiring speech keyword enrollment, our method compares input queries with an enrolled text keyword sequence. To place the audio and text representations within a common latent space, we adopt an attention-based cross-modal matching approach that is trained in an end-to-end manner with monotonic matching loss and keyword classification loss. We also utilize a de-noising loss for the acoustic embedding network to improve robustness in noisy environments. Additionally, we introduce the LibriPhrase dataset, a new short-phrase dataset based on LibriSpeech for efficiently training keyword spotting models. Our proposed method achieves competitive results on various evaluation sets compared to other single-modal and cross-modal baselines.  ( 2 min )

Forecasting future world events is a challenging but valuable task. Forecasts of climate, geopolitical conflict, pandemics and economic indicators help shape policy and decision making. In these domains, the judgment of expert humans contributes to the best forecasts. Given advances in language modeling, can these forecasts be automated? To this end, we introduce Autocast, a dataset containing thousands of forecasting questions and an accompanying news corpus. Questions are taken from forecasting tournaments, ensuring high quality, real-world importance, and diversity. The news corpus is organized by date, allowing us to precisely simulate the conditions under which humans made past forecasts (avoiding leakage from the future). Motivated by the difficulty of forecasting numbers across orders of magnitude (e.g. global cases of COVID-19 in 2022), we also curate IntervalQA, a dataset of numerical questions and metrics for calibration. We test language models on our forecasting task and find that performance is far below a human expert baseline. However, performance improves with increased model size and incorporation of relevant information from the news corpus. In sum, Autocast poses a novel challenge for large language models and improved performance could bring large practical benefits.  ( 3 min )

In recent years, significant advances have been made in the design and evaluation of balanced (hyper)graph partitioning algorithms. We survey trends of the last decade in practical algorithms for balanced (hyper)graph partitioning together with future research directions. Our work serves as an update to a previous survey on the topic. In particular, the survey extends the previous survey by also covering hypergraph partitioning and streaming algorithms, and has an additional focus on parallel algorithms.  ( 2 min )

Using decentralized data for federated training is one promising emerging research direction for alleviating data scarcity in the medical domain. However, in contrast to large-scale fully labeled data commonly seen in general object recognition tasks, the local medical datasets are more likely to only have images annotated for a subset of classes of interest due to high annotation costs. In this paper, we consider a practical yet under-explored problem, where underrepresented classes only have few labeled instances available and only exist in a few clients of the federated system. We show that standard federated learning approaches fail to learn robust multi-label classifiers with extreme class imbalance and address it by proposing a novel federated learning framework, FedFew. FedFew consists of three stages, where the first stage leverages federated self-supervised learning to learn class-agnostic representations. In the second stage, the decentralized partially labeled data are exploited to learn an energy-based multi-label classifier for the common classes. Finally, the underrepresented classes are detected based on the energy and a prototype-based nearest-neighbor model is proposed for few-shot matching. We evaluate FedFew on multi-label thoracic disease classification tasks and demonstrate that it outperforms the federated baselines by a large margin.  ( 2 min )

Automated decision support systems that are able to infer second opinions from experts can potentially facilitate a more efficient allocation of resources; they can help decide when and from whom to seek a second opinion. In this paper, we look at the design of this type of support systems from the perspective of counterfactual inference. We focus on a multiclass classification setting and first show that, if experts make predictions on their own, the underlying causal mechanism generating their predictions needs to satisfy a desirable set invariant property. Further, we show that, for any causal mechanism satisfying this property, there exists an equivalent mechanism where the predictions by each expert are generated by independent sub-mechanisms governed by a common noise. This motivates the design of a set invariant Gumbel-Max structural causal model where the structure of the noise governing the sub-mechanisms underpinning the model depends on an intuitive notion of similarity between experts which can be estimated from data. Experiments on both synthetic and real data show that our model can be used to infer second opinions more accurately than its non-causal counterpart.  ( 2 min )

We trained a keyword spotting model using federated learning on real user devices and observed significant improvements when the model was deployed for inference on phones. To compensate for data domains that are missing from on-device training caches, we employed joint federated-centralized training. And to learn in the absence of curated labels on-device, we formulated a confidence filtering strategy based on user-feedback signals for federated distillation. These techniques created models that significantly improved quality metrics in offline evaluations and user-experience metrics in live A/B experiments.  ( 2 min )

Reconstructing 3D objects from 2D images is both challenging for our brains and machine learning algorithms. To support this spatial reasoning task, contextual information about the overall shape of an object is critical. However, such information is not captured by established loss terms (e.g. Dice loss). We propose to complement geometrical shape information by including multi-scale topological features, such as connected components, cycles, and voids, in the reconstruction loss. Our method uses cubical complexes to calculate topological features of 3D volume data and employs an optimal transport distance to guide the reconstruction process. This topology-aware loss is fully differentiable, computationally efficient, and can be added to any neural network. We demonstrate the utility of our loss by incorporating it into SHAPR, a model for predicting the 3D cell shape of individual cells based on 2D microscopy images. Using a hybrid loss that leverages both geometrical and topological information of single objects to assess their shape, we find that topological information substantially improves the quality of reconstructions, thus highlighting its ability to extract more relevant features from image datasets.  ( 3 min )

We propose a margin-based loss for vision-language model pretraining that encourages gradient-based explanations that are consistent with region-level annotations. We refer to this objective as Attention Mask Consistency (AMC) and demonstrate that it produces superior visual grounding performance compared to models that rely instead on region-level annotations for explicitly training an object detector such as Faster R-CNN. AMC works by encouraging gradient-based explanation masks that focus their attention scores mostly within annotated regions of interest for images that contain such annotations. Particularly, a model trained with AMC on top of standard vision-language modeling objectives obtains a state-of-the-art accuracy of 86.59% in the Flickr30k visual grounding benchmark, an absolute improvement of 5.48% when compared to the best previous model. Our approach also performs exceedingly well on established benchmarks for referring expression comprehension and offers the added benefit by design of gradient-based explanations that better align with human annotations.  ( 2 min )

We review current solutions and technical challenges for automatic speech recognition, keyword spotting, device arbitration, speech enhancement, and source localization in multidevice home environments to provide context for the INTERSPEECH 2022 special session, "Challenges and opportunities for signal processing and machine learning for multiple smart devices". We also identify the datasets needed to support these research areas. Based on the review and our research experience in the multi-device domain, we conclude with an outlook on the future evolution  ( 2 min )

The ability to separate signal from noise, and reason with clean abstractions, is critical to intelligence. With this ability, humans can efficiently perform real world tasks without considering all possible nuisance factors.How can artificial agents do the same? What kind of information can agents safely discard as noises? In this work, we categorize information out in the wild into four types based on controllability and relation with reward, and formulate useful information as that which is both controllable and reward-relevant. This framework clarifies the kinds information removed by various prior work on representation learning in reinforcement learning (RL), and leads to our proposed approach of learning a Denoised MDP that explicitly factors out certain noise distractors. Extensive experiments on variants of DeepMind Control Suite and RoboDesk demonstrate superior performance of our denoised world model over using raw observations alone, and over prior works, across policy optimization control tasks as well as the non-control task of joint position regression.  ( 2 min )

Causal Machine Learning (CausalML) is an umbrella term for machine learning methods that formalize the data-generation process as a structural causal model (SCM). This allows one to reason about the effects of changes to this process (i.e., interventions) and what would have happened in hindsight (i.e., counterfactuals). We categorize work in \causalml into five groups according to the problems they tackle: (1) causal supervised learning, (2) causal generative modeling, (3) causal explanations, (4) causal fairness, (5) causal reinforcement learning. For each category, we systematically compare its methods and point out open problems. Further, we review modality-specific applications in computer vision, natural language processing, and graph representation learning. Finally, we provide an overview of causal benchmarks and a critical discussion of the state of this nascent field, including recommendations for future work.  ( 2 min )

Text-to-Speech (TTS) services that run on edge devices have many advantages compared to cloud TTS, e.g., latency and privacy issues. However, neural vocoders with a low complexity and small model footprint inevitably generate annoying sounds. This study proposes a Bunched LPCNet2, an improved LPCNet architecture that provides highly efficient performance in high-quality for cloud servers and in a low-complexity for low-resource edge devices. Single logistic distribution achieves computational efficiency, and insightful tricks reduce the model footprint while maintaining speech quality. A DualRate architecture, which generates a lower sampling rate from a prosody model, is also proposed to reduce maintenance costs. The experiments demonstrate that Bunched LPCNet2 generates satisfactory speech quality with a model footprint of 1.1MB while operating faster than real-time on a RPi 3B. Our audio samples are available at https://srtts.github.io/bunchedLPCNet2.  ( 2 min )

Tuning machine parameters of particle accelerators is a repetitive and time-consuming task that is challenging to automate. While many off-the-shelf optimization algorithms are available, in practice their use is limited because most methods do not account for safety-critical constraints in each iteration, such as loss signals or step-size limitations. One notable exception is safe Bayesian optimization, which is a data-driven tuning approach for global optimization with noisy feedback. We propose and evaluate a step-size limited variant of safe Bayesian optimization on two research facilities of the Paul Scherrer Institut (PSI): a) the Swiss Free Electron Laser (SwissFEL) and b) the High-Intensity Proton Accelerator (HIPA). We report promising experimental results on both machines, tuning up to 16 parameters subject to 224 constraints.  ( 2 min )

This paper presents a deep reinforcement learning agent (AI) that uses sound as the input on the DareFightingICE platform at the DareFightingICE Competition in IEEE CoG 2022. In this work, an AI that only uses sound as the input is called blind AI. While state-of-the-art AIs rely mostly on visual or structured observations provided by their environments, learning to play games from only sound is still new and thus challenging. We propose different approaches to process audio data and use the Proximal Policy Optimization algorithm for our blind AI. We also propose to use our blind AI in evaluation of sound designs submitted to the competition and define two metrics for this task. The experimental results show the effectiveness of not only our blind AI but also the proposed two metrics.  ( 2 min )

Imitation learning holds tremendous promise in learning policies efficiently for complex decision making problems. Current state-of-the-art algorithms often use inverse reinforcement learning (IRL), where given a set of expert demonstrations, an agent alternatively infers a reward function and the associated optimal policy. However, such IRL approaches often require substantial online interactions for complex control problems. In this work, we present Regularized Optimal Transport (ROT), a new imitation learning algorithm that builds on recent advances in optimal transport based trajectory-matching. Our key technical insight is that adaptively combining trajectory-matching rewards with behavior cloning can significantly accelerate imitation even with only a few demonstrations. Our experiments on 20 visual control tasks across the DeepMind Control Suite, the OpenAI Robotics Suite, and the Meta-World Benchmark demonstrate an average of 7.8X faster imitation to reach 90% of expert performance compared to prior state-of-the-art methods. On real-world robotic manipulation, with just one demonstration and an hour of online training, ROT achieves an average success rate of 90.1% across 14 tasks.  ( 2 min )

The evolution of an isolated quantum system is linear, and hence quantum algorithms are reversible, including those that utilize quantum circuits as generative machine learning models. However, some of the most successful classical generative models, such as those based on neural networks, involve highly non-linear and thus non-reversible dynamics. In this paper, we explore the effect of these dynamics in quantum generative modeling by introducing a model that adds non-linear activations via a neural network structure onto the standard Born Machine framework - the Quantum Neuron Born Machine (QNBM). To achieve this, we utilize a previously introduced Quantum Neuron subroutine, which is a repeat-until-success circuit with mid-circuit measurements and classical control. After introducing the QNBM, we investigate how its performance depends on network size, by training a 3-layer QNBM with 4 output neurons and various input and hidden layer sizes. We then compare our non-linear QNBM to the linear Quantum Circuit Born Machine (QCBM). We allocate similar time and memory resources to each model, such that the only major difference is the qubit overhead required by the QNBM. With gradient-based training, we show that while both models can easily learn a trivial uniform probability distribution, on a more challenging class of distributions, the QNBM achieves an almost 3x smaller error rate than a QCBM with a similar number of tunable parameters. We therefore provide evidence that suggests that non-linearity is a useful resource in quantum generative models, and we put forth the QNBM as a new model with good generative performance and potential for quantum advantage.  ( 3 min )

QuASK is a quantum machine learning software written in Python that supports researchers in designing, experimenting, and assessing different quantum and classical kernels performance. This software is package agnostic and can be integrated with all major quantum software packages (e.g. IBM Qiskit, Xanadu's Pennylane, Amazon Braket). QuASK guides the user through a simple preprocessing of input data, definition and calculation of quantum and classical kernels, either custom or pre-defined ones. From this evaluation the package provides an assessment about potential quantum advantage and prediction bounds on generalization error. Moreover, it allows for the generation of parametric quantum kernels that can be trained using gradient-descent-based optimization, grid search, or genetic algorithms. Projected quantum kernels, an effective solution to mitigate the curse of dimensionality induced by the exponential scaling dimension of large Hilbert spaces, are also calculated. QuASK can furthermore generate the observable values of a quantum model and use them to study the prediction capabilities of the quantum and classical kernels.  ( 2 min )

Learning a new language involves constantly comparing speech productions with reference productions from the environment. Early in speech acquisition, children make articulatory adjustments to match their caregivers' speech. Grownup learners of a language tweak their speech to match the tutor reference. This paper proposes a method to synthetically generate correct pronunciation feedback given incorrect production. Furthermore, our aim is to generate the corrected production while maintaining the speaker's original voice. The system prompts the user to pronounce a phrase. The speech is recorded, and the samples associated with the inaccurate phoneme are masked with zeros. This waveform serves as an input to a speech generator, implemented as a deep learning inpainting system with a U-net architecture, and trained to output a reconstructed speech. The training set is composed of unimpaired proper speech examples, and the generator is trained to reconstruct the original proper speech. We evaluated the performance of our system on phoneme replacement of minimal pair words of English as well as on children with pronunciation disorders. Results suggest that human listeners slightly prefer our generated speech over a smoothed replacement of the inaccurate phoneme with a production of a different speaker.  ( 3 min )

Transformers are neural network models that utilize multiple layers of self-attention heads. Attention is implemented in transformers as the contextual embeddings of the 'key' and 'query'. Transformers allow the re-combination of attention information from different layers and the processing of all inputs at once, which are more convenient than recurrent neural networks when dealt with a large number of data. Transformers have exhibited great performances on natural language processing tasks in recent years. Meanwhile, there have been tremendous efforts to adapt transformers into other fields of machine learning, such as Swin Transformer and Decision Transformer. Swin Transformer is a promising neural network architecture that splits image pixels into small patches and applies local self-attention operations inside the (shifted) windows of fixed sizes. Decision Transformer has successfully applied transformers to off-line reinforcement learning and showed that random-walk samples from Atari games are sufficient to let an agent learn optimized behaviors. However, it is considerably more challenging to combine online reinforcement learning with transformers. In this article, we further explore the possibility of not modifying the reinforcement learning policy, but only replacing the convolutional neural network architecture with the self-attention architecture from Swin Transformer. Namely, we target at changing how an agent views the world, but not how an agent plans about the world. We conduct our experiment on 49 games in Arcade Learning Environment. The results show that using Swin Transformer in reinforcement learning achieves significantly higher evaluation scores across the majority of games in Arcade Learning Environment. Thus, we conclude that online reinforcement learning can benefit from exploiting self-attentions with spatial token embeddings.  ( 3 min )

Offline reinforcement learning (RL) can learn control policies from static datasets but, like standard RL methods, it requires reward annotations for every transition. In many cases, labeling large datasets with rewards may be costly, especially if those rewards must be provided by human labelers, while collecting diverse unlabeled data might be comparatively inexpensive. How can we best leverage such unlabeled data in offline RL? One natural solution is to learn a reward function from the labeled data and use it to label the unlabeled data. In this paper, we find that, perhaps surprisingly, a much simpler method that simply applies zero rewards to unlabeled data leads to effective data sharing both in theory and in practice, without learning any reward model at all. While this approach might seem strange (and incorrect) at first, we provide extensive theoretical and empirical analysis that illustrates how it trades off reward bias, sample complexity and distributional shift, often leading to good results. We characterize conditions under which this simple strategy is effective, and further show that extending it with a simple reweighting approach can further alleviate the bias introduced by using incorrect reward labels. Our empirical evaluation confirms these findings in simulated robotic locomotion, navigation, and manipulation settings.  ( 3 min )

This work discusses how to derive upper bounds for the expected generalisation error of supervised learning algorithms by means of the chaining technique. By developing a general theoretical framework, we establish a duality between generalisation bounds based on the regularity of the loss function, and their chained counterparts, which can be obtained by lifting the regularity assumption from the loss onto its gradient. This allows us to re-derive the chaining mutual information bound from the literature, and to obtain novel chained information-theoretic generalisation bounds, based on the Wasserstein distance and other probability metrics. We show on some toy examples that the chained generalisation bound can be significantly tighter than its standard counterpart, particularly when the distribution of the hypotheses selected by the algorithm is very concentrated. Keywords: Generalisation bounds; Chaining; Information-theoretic bounds; Mutual information; Wasserstein distance; PAC-Bayes.  ( 2 min )

Depth maps are needed by various graphics rendering and processing operations. Depth map streaming is often necessary when such operations are performed in a distributed system and it requires in most cases fast performing compression, which is why video codecs are often used. Hardware implementations of standard video codecs enable relatively high resolution and framerate combinations, even on resource constrained devices, but unfortunately those implementations do not currently support RGB+depth extensions. However, they can be used for depth compression by first packing the depth maps into RGB or YUV frames. We investigate depth map compression using a combination of depth map packing followed by encoding with a standard video codec. We show that the precision at which depth maps are packed has a large and nontrivial impact on the resulting error caused by the combination of the packing scheme and lossy compression when bitrate is constrained. Consequently, we propose a variable precision packing scheme assisted by a neural network model that predicts the optimal precision for each depth map given a bitrate constraint. We demonstrate that the model yields near optimal predictions and that it can be integrated into a game engine with very low overhead using modern hardware.  ( 2 min )

Model-based treatment planning for transcranial ultrasound therapy typically involves mapping the acoustic properties of the skull from an x-ray computed tomography (CT) image of the head. Here, three methods for generating pseudo-CT images from magnetic resonance (MR) images were compared as an alternative to CT. A convolutional neural network (U-Net) was trained on paired MR-CT images to generate pseudo-CT images from either T1-weighted or zero-echo time (ZTE) MR images (denoted tCT and zCT, respectively). A direct mapping from ZTE to pseudo-CT was also implemented (denoted cCT). When comparing the pseudo-CT and ground truth CT images for the test set, the mean absolute error was 133, 83, and 145 Hounsfield units (HU) across the whole head, and 398, 222, and 336 HU within the skull for the tCT, zCT, and cCT images, respectively. Ultrasound simulations were also performed using the generated pseudo-CT images and compared to simulations based on CT. An annular array transducer was used targeting the visual or motor cortex. The mean differences in the simulated focal pressure, focal position, and focal volume were 9.9%, 1.5 mm, and 15.1% for simulations based on the tCT images, 5.7%, 0.6 mm, and 5.7% for the zCT, and 6.7%, 0.9 mm, and 12.1% for the cCT. The improved results for images mapped from ZTE highlight the advantage of using imaging sequences which improve contrast of the skull bone. Overall, these results demonstrate that acoustic simulations based on MR images can give comparable accuracy to those based on CT.  ( 3 min )

Precipitation forecasting is an important scientific challenge that has wide-reaching impacts on society. Historically, this challenge has been tackled using numerical weather prediction (NWP) models, grounded on physics-based simulations. Recently, many works have proposed an alternative approach, using end-to-end deep learning (DL) models to replace physics-based NWP. While these DL methods show improved performance and computational efficiency, they exhibit limitations in long-term forecasting and lack the explainability of NWP models. In this work, we present a hybrid NWP-DL workflow to fill the gap between standalone NWP and DL approaches. Under this workflow, the NWP output is fed into a deep model, which post-processes the data to yield a refined precipitation forecast. The deep model is trained with supervision, using Automatic Weather Station (AWS) observations as ground-truth labels. This can achieve the best of both worlds, and can even benefit from future improvements in NWP technology. To facilitate study in this direction, we present a novel dataset focused on the Korean Peninsula, termed KoMet (Korea Meteorological Dataset), comprised of NWP predictions and AWS observations. For NWP, we use the Global Data Assimilation and Prediction Systems-Korea Integrated Model (GDAPS-KIM).  ( 2 min )

We propose a general deep architecture for learning functions on multiple permutation-invariant sets. We also show how to generalize this architecture to sets of elements of any dimension by dimension equivariance. We demonstrate that our architecture is a universal approximator of these functions, and show superior results to existing methods on a variety of tasks including counting tasks, alignment tasks, distinguishability tasks and statistical distance measurements. This last task is quite important in Machine Learning. Although our approach is quite general, we demonstrate that it can generate approximate estimates of KL divergence and mutual information that are more accurate than previous techniques that are specifically designed to approximate those statistical distances.  ( 2 min )

This paper substantially extends our work published at ECCV, in which an intermediate-level attack was proposed to improve the transferability of some baseline adversarial examples. Specifically, we advocate a framework in which a direct linear mapping from the intermediate-level discrepancies (between adversarial features and benign features) to prediction loss of the adversarial example is established. By delving deep into the core components of such a framework, we show that 1) a variety of linear regression models can all be considered in order to establish the mapping, 2) the magnitude of the finally obtained intermediate-level adversarial discrepancy is correlated with the transferability, 3) further boost of the performance can be achieved by performing multiple runs of the baseline attack with random initialization. In addition, by leveraging these findings, we achieve new state-of-the-arts on transfer-based $\ell_\infty$ and $\ell_2$ attacks. Our code is publicly available at https://github.com/qizhangli/ila-plus-plus-lr.  ( 2 min )

Link prediction aims to predict links of a network that are not directly visible, with profound applications in biological and social systems. Despite intensive utilization of the topological feature in this task, it is unclear to what extent a particular feature can be leveraged to infer missing links. Here, we show that the maximum capability of a topological feature follows a simple mathematical expression, which is independent of how an index gauges the feature. Hence, a family of indexes associated with one topological feature shares the same performance limit. A feature's capability is lifted in the supervised prediction, which in general gives rise to better results compared with unsupervised prediction. The universality of the pattern uncovered is empirically verified by 550 structurally diverse networks, which can be applied to feature selection and the analysis of network characteristics associated with a topological feature in link prediction.  ( 2 min )

We initiate the study of online routing problems with predictions, inspired by recent exciting results in the area of learning-augmented algorithms. A learning-augmented online algorithm which incorporates predictions in a black-box manner to outperform existing algorithms if the predictions are accurate while otherwise maintaining theoretical guarantees even when the predictions are extremely erroneous is a popular framework for overcoming pessimistic worst-case competitive analysis. In this study, we particularly begin investigating the classical online traveling salesman problem (OLTSP), where future requests are augmented with predictions. Unlike the prediction models in other previous studies, each actual request in the OLTSP, associated with its arrival time and position, may not coincide with the predicted ones, which, as imagined, leads to a troublesome situation. Our main result is to study different prediction models and design algorithms to improve the best-known results in the different settings. Moreover, we generalize the proposed results to the online dial-a-ride problem.  ( 2 min )

The natural gradient field is a vector field that lives on a model equipped with a distinguished Riemannian metric, e.g. the Fisher-Rao metric, and represents the direction of steepest ascent of an objective function on the model with respect to this metric. In practice, one tries to obtain the corresponding direction on the parameter space by multiplying the ordinary gradient by the inverse of the Gram matrix associated with the metric. We refer to this vector on the parameter space as the natural parameter gradient. In this paper we study when the pushforward of the natural parameter gradient is equal to the natural gradient. Furthermore we investigate the invariance properties of the natural parameter gradient. Both questions are addressed in an overparametrised setting.  ( 2 min )

The competitive Coding approach (CompCode) is one of the most promising methods for palmprint recognition. Due to its high performance and simple formulation, it has been continuously studied for many years. However, although numerous variations of CompCode have been proposed, a detailed analysis of the method is still absent. In this paper, we provide a detailed analysis of CompCode from the perspective of linear discriminant analysis (LDA) for the first time. A non-trivial sufficient condition under which the CompCode is optimal in the sense of Fisher's criterion is presented. Based on our analysis, we examined the statistics of palmprints and concluded that CompCode deviates from the optimal condition. To mitigate the deviation, we propose a new method called Class-Specific CompCode that improves CompCode by excluding non-palm-line areas from matching. A nonlinear mapping of the competitive code is also applied in this method to further enhance accuracy. Experiments on two public databases demonstrate the effectiveness of the proposed method.  ( 2 min )

Machine learning (ML) interpretability techniques can reveal undesirable patterns in data that models exploit to make predictions--potentially causing harms once deployed. However, how to take action to address these patterns is not always clear. In a collaboration between ML and human-computer interaction researchers, physicians, and data scientists, we develop GAM Changer, the first interactive system to help domain experts and data scientists easily and responsibly edit Generalized Additive Models (GAMs) and fix problematic patterns. With novel interaction techniques, our tool puts interpretability into action--empowering users to analyze, validate, and align model behaviors with their knowledge and values. Physicians have started to use our tool to investigate and fix pneumonia and sepsis risk prediction models, and an evaluation with 7 data scientists working in diverse domains highlights that our tool is easy to use, meets their model editing needs, and fits into their current workflows. Built with modern web technologies, our tool runs locally in users' web browsers or computational notebooks, lowering the barrier to use. GAM Changer is available at the following public demo link: https://interpret.ml/gam-changer.  ( 3 min )

The use of machine learning in Structural Health Monitoring is becoming more common, as many of the inherent tasks (such as regression and classification) in developing condition-based assessment fall naturally into its remit. This chapter introduces the concept of physics-informed machine learning, where one adapts ML algorithms to account for the physical insight an engineer will often have of the structure they are attempting to model or assess. The chapter will demonstrate how grey-box models, that combine simple physics-based models with data-driven ones, can improve predictive capability in an SHM setting. A particular strength of the approach demonstrated here is the capacity of the models to generalise, with enhanced predictive capability in different regimes. This is a key issue when life-time assessment is a requirement, or when monitoring data do not span the operational conditions a structure will undergo. The chapter will provide an overview of physics-informed ML, introducing a number of new approaches for grey-box modelling in a Bayesian setting. The main ML tool discussed will be Gaussian process regression, we will demonstrate how physical assumptions/models can be incorporated through constraints, through the mean function and kernel design, and finally in a state-space setting. A range of SHM applications will be demonstrated, from loads monitoring tasks for off-shore and aerospace structures, through to performance monitoring for long-span bridges.  ( 3 min )

The recent proliferation of real-world human mobility datasets has catalyzed geospatial and transportation research in trajectory prediction, demand forecasting, travel time estimation, and anomaly detection. However, these datasets also enable, more broadly, a descriptive analysis of intricate systems of human mobility. We formally define patterns of life analysis as a natural, explainable extension of online unsupervised anomaly detection, where we not only monitor a data stream for anomalies but also explicitly extract normal patterns over time. To learn patterns of life, we adapt Grow When Required (GWR) episodic memory from research in computational biology and neurorobotics to a new domain of geospatial analysis. This biologically-inspired neural network, related to self-organizing maps (SOM), constructs a set of "memories" or prototype traffic patterns incrementally as it iterates over the GPS stream. It then compares each new observation to its prior experiences, inducing an online, unsupervised clustering and anomaly detection on the data. We mine patterns-of-interest from the Porto taxi dataset, including both major public holidays and newly-discovered transportation anomalies, such as festivals and concerts which, to our knowledge, have not been previously acknowledged or reported in prior work. We anticipate that the capability to incrementally learn normal and abnormal road transportation behavior will be useful in many domains, including smart cities, autonomous vehicles, and urban planning and management.  ( 3 min )

Active learning maximizes the hypothesis updates to find those desired unlabeled data. An inherent assumption is that this learning manner can derive those updates into the optimal hypothesis. However, its convergence may not be guaranteed well if those incremental updates are negative and disordered. In this paper, we introduce a machine teacher who provides a black-box teaching hypothesis for an active learner, where the teaching hypothesis is an effective approximation for the optimal hypothesis. Theoretically, we prove that, under the guidance of this teaching hypothesis, the learner can converge into a tighter generalization error and label complexity bound than those non-educated learners who do not receive any guidance from a teacher. We further consider two teaching scenarios: teaching a white-box and black-box learner, where self-improvement of teaching is firstly proposed to improve the teaching performance. Experiments verify this idea and show better performance than the fundamental active learning strategies, such as IWAL, IWAL-D, etc.  ( 2 min )

Reinforcement learning (RL) involves performing exploratory actions in an unknown system. This can place a learning agent in dangerous and potentially catastrophic system states. Current approaches for tackling safe learning in RL simultaneously trade-off safe exploration and task fulfillment. In this paper, we introduce a new generation of RL solvers that learn to minimise safety violations while maximising the task reward to the extent that can be tolerated by the safe policy. Our approach introduces a novel two-player framework for safe RL called Distributive Exploration Safety Training Algorithm (DESTA). The core of DESTA is a game between two adaptive agents: Safety Agent that is delegated the task of minimising safety violations and Task Agent whose goal is to maximise the environment reward. Specifically, Safety Agent can selectively take control of the system at any given point to prevent safety violations while Task Agent is free to execute its policy at any other states. This framework enables Safety Agent to learn to take actions at certain states that minimise future safety violations, both during training and testing time, while Task Agent performs actions that maximise the task performance everywhere else. Theoretically, we prove that DESTA converges to stable points enabling safety violations of pretrained policies to be minimised. Empirically, we show DESTA's ability to augment the safety of existing policies and secondly, construct safe RL policies when the Task Agent and Safety Agent are trained concurrently. We demonstrate DESTA's superior performance against leading RL methods in Lunar Lander and Frozen Lake from OpenAI gym.  ( 3 min )

Load forecasting is very essential in the analysis and grid planning of power systems. For this reason, we first propose a household load forecasting method based on federated deep learning and non-intrusive load monitoring (NILM). For all we know, this is the first research on federated learning (FL) in household load forecasting based on NILM. In this method, the integrated power is decomposed into individual device power by non-intrusive load monitoring, and the power of individual appliances is predicted separately using a federated deep learning model. Finally, the predicted power values of individual appliances are aggregated to form the total power prediction. Specifically, by separately predicting the electrical equipment to obtain the predicted power, it avoids the error caused by the strong time dependence in the power signal of a single device. And in the federated deep learning prediction model, the household owners with the power data share the parameters of the local model instead of the local power data, guaranteeing the privacy of the household user data. The case results demonstrate that the proposed approach provides a better prediction effect than the traditional methodology that directly predicts the aggregated signal as a whole. In addition, experiments in various federated learning environments are designed and implemented to validate the validity of this methodology.  ( 3 min )

Procrastination, the irrational delay of tasks, is a common occurrence in online learning. Potential negative consequences include higher risk of drop-outs, increased stress, and reduced mood. Due to the rise of learning management systems and learning analytics, indicators of such behavior can be detected, enabling predictions of future procrastination and other dilatory behavior. However, research focusing on such predictions is scarce. Moreover, studies involving different types of predictors and comparisons between the predictive performance of various methods are virtually non-existent. In this study, we aim to fill these research gaps by analyzing the performance of multiple machine learning algorithms when predicting the delayed or timely submission of online assignments in a higher education setting with two categories of predictors: subjective, questionnaire-based variables and objective, log-data based indicators extracted from a learning management system. The results show that models with objective predictors consistently outperform models with subjective predictors, and a combination of both variable types perform slightly better. For each of these three options, a different approach prevailed (Gradient Boosting Machines for the subjective, Bayesian multilevel models for the objective, and Random Forest for the combined predictors). We conclude that careful attention should be paid to the selection of predictors and algorithms before implementing such models in learning management systems.  ( 3 min )

Deep learning has excelled on complex pattern recognition tasks such as image classification and object recognition. However, it struggles with tasks requiring nontrivial reasoning, such as algorithmic computation. Humans are able to solve such tasks through iterative reasoning -- spending more time thinking about harder tasks. Most existing neural networks, however, exhibit a fixed computational budget controlled by the neural network architecture, preventing additional computational processing on harder tasks. In this work, we present a new framework for iterative reasoning with neural networks. We train a neural network to parameterize an energy landscape over all outputs, and implement each step of the iterative reasoning as an energy minimization step to find a minimal energy solution. By formulating reasoning as an energy minimization problem, for harder problems that lead to more complex energy landscapes, we may then adjust our underlying computational budget by running a more complex optimization procedure. We empirically illustrate that our iterative reasoning approach can solve more accurate and generalizable algorithmic reasoning tasks in both graph and continuous domains. Finally, we illustrate that our approach can recursively solve algorithmic problems requiring nested reasoning  ( 2 min )

A variety of fairness constraints have been proposed in the literature to mitigate group-level statistical bias. Their impacts have been largely evaluated for different groups of populations corresponding to a set of sensitive attributes, such as race or gender. Nonetheless, the community has not observed sufficient explorations for how imposing fairness constraints fare at an instance level. Building on the concept of influence function, a measure that characterizes the impact of a training example on the target model and its predictive performance, this work studies the influence of training examples when fairness constraints are imposed. We find out that under certain assumptions, the influence function with respect to fairness constraints can be decomposed into a kernelized combination of training examples. One promising application of the proposed fairness influence function is to identify suspicious training examples that may cause model discrimination by ranking their influence scores. We demonstrate with extensive experiments that training on a subset of weighty data examples leads to lower fairness violations with a trade-off of accuracy.  ( 2 min )

Learning nonparametric systems of Ordinary Differential Equations (ODEs) $\dot x = f(t,x)$ from noisy and sparse data is an emerging machine learning topic. We use the well-developed theory of Reproducing Kernel Hilbert Spaces (RKHS) to define candidates for $f$ for which the solution of the ODE exists and is unique. Learning $f$ consists of solving a constrained optimization problem in an RKHS. We propose a penalty method that iteratively uses the Representer theorem and Euler approximations to provide a numerical solution. We prove a generalization bound for the $L^2$ distance between $x$ and its estimator. Experiments are provided for the FitzHugh Nagumo oscillator and for the prediction of the Amyloid level in the cortex of aging subjects. In both cases, we show competitive results when compared with the state of the art.  ( 2 min )

We propose a novel anomaly detection method for echocardiogram videos. The introduced method takes advantage of the periodic nature of the heart cycle to learn different variants of a variational latent trajectory model (TVAE). The models are trained on the healthy samples of an in-house dataset of infant echocardiogram videos consisting of multiple chamber views to learn a normative prior of the healthy population. During inference, maximum a posteriori (MAP) based anomaly detection is performed to detect out-of-distribution samples in our dataset. The proposed method reliably identifies severe congenital heart defects, such as Ebstein's Anomaly or Shonecomplex. Moreover, it achieves superior performance over MAP-based anomaly detection with standard variational autoencoders on the task of detecting pulmonary hypertension and right ventricular dilation. Finally, we demonstrate that the proposed method provides interpretable explanations of its output through heatmaps which highlight the regions corresponding to anomalous heart structures.  ( 2 min )

This paper introduces R-MelNet, a two-part autoregressive architecture with a frontend based on the first tier of MelNet and a backend WaveRNN-style audio decoder for neural text-to-speech synthesis. Taking as input a mixed sequence of characters and phonemes, with an optional audio priming sequence, this model produces low-resolution mel-spectral features which are interpolated and used by a WaveRNN decoder to produce an audio waveform. Coupled with half precision training, R-MelNet uses under 11 gigabytes of GPU memory on a single commodity GPU (NVIDIA 2080Ti). We detail a number of critical implementation details for stable half precision training, including an approximate, numerically stable mixture of logistics attention. Using a stochastic, multi-sample per step inference scheme, the resulting model generates highly varied audio, while enabling text and audio based controls to modify output waveforms. Qualitative and quantitative evaluations of an R-MelNet system trained on a single speaker TTS dataset demonstrate the effectiveness of our approach.  ( 2 min )

Sequences arise in many real-world scenarios; thus, identifying the mechanisms behind symbol generation is essential to understanding many complex systems. This paper analyzes sequences generated by agents walking on a networked topology. Given that in many real scenarios, the underlying processes generating the sequence is hidden, we investigate whether the reconstruction of the network via the co-occurrence method is useful to recover both the network topology and agent dynamics generating sequences. We found that the characterization of reconstructed networks provides valuable information regarding the process and topology used to create the sequences. In a machine learning approach considering 16 combinations of network topology and agent dynamics as classes, we obtained an accuracy of 87% with sequences generated with less than 40% of nodes visited. Larger sequences turned out to generate improved machine learning models. Our findings suggest that the proposed methodology could be extended to classify sequences and understand the mechanisms behind sequence generation.  ( 2 min )

Machine learning (ML) may improve and automate quality control (QC) in injection moulding manufacturing. As the labelling of extensive, real-world process data is costly, however, the use of simulated process data may offer a first step towards a successful implementation. In this study, simulated data was used to develop a predictive model for the product quality of an injection moulded sorting container. The achieved accuracy, specificity and sensitivity on the test set was $99.4\%$, $99.7\%$ and $94.7\%$, respectively. This study thus shows the potential of ML towards automated QC in injection moulding and encourages the extension to ML models trained on real-world data.  ( 2 min )

Analyzing the distribution shift of data is a growing research direction in nowadays Machine Learning, leading to emerging new benchmarks that focus on providing a suitable scenario for studying the generalization properties of ML models. The existing benchmarks are focused on supervised learning, and to the best of our knowledge, there is none for unsupervised learning. Therefore, we introduce an unsupervised anomaly detection benchmark with data that shifts over time, built over Kyoto-2006+, a traffic dataset for network intrusion detection. This kind of data meets the premise of shifting the input distribution: it covers a large time span ($10$ years), with naturally occurring changes over time (\eg users modifying their behavior patterns, and software updates). We first highlight the non-stationary nature of the data, using a basic per-feature analysis, t-SNE, and an Optimal Transport approach for measuring the overall distribution distances between years. Next, we propose AnoShift, a protocol splitting the data in IID, NEAR, and FAR testing splits. We validate the performance degradation over time with diverse models (MLM to classical Isolation Forest). Finally, we show that by acknowledging the distribution shift problem and properly addressing it, the performance can be improved compared to the classical IID training (by up to $3\%$, on average). Dataset and code are available at https://github.com/bit-ml/AnoShift/.  ( 2 min )

There has been a massive increase in research interest towards applying data driven methods to problems in mechanics. While traditional machine learning (ML) methods have enabled many breakthroughs, they rely on the assumption that the training (observed) data and testing (unseen) data are independent and identically distributed (i.i.d). Thus, traditional ML approaches often break down when applied to real world mechanics problems with unknown test environments and data distribution shifts. In contrast, out-of-distribution (OOD) generalization assumes that the test data may shift (i.e., violate the i.i.d. assumption). To date, multiple methods have been proposed to improve the OOD generalization of ML methods. However, because of the lack of benchmark datasets for OOD regression problems, the efficiency of these OOD methods on regression problems, which dominate the mechanics field, remains unknown. To address this, we investigate the performance of OOD generalization methods for regression problems in mechanics. Specifically, we identify three OOD problems: covariate shift, mechanism shift, and sampling bias. For each problem, we create two benchmark examples that extend the Mechanical MNIST dataset collection, and we investigate the performance of popular OOD generalization methods on these mechanics-specific regression problems. Our numerical experiments show that in most cases, while the OOD generalization algorithms perform better compared to traditional ML methods on these OOD problems, there is a compelling need to develop more robust OOD generalization methods that are effective across multiple OOD scenarios. Overall, we expect that this study, as well as the associated open access benchmark datasets, will enable further development of OOD generalization methods for mechanics specific regression problems.  ( 3 min )

Today, machine learning is applied in almost any field. In machine learning, where there are numerous methods, classification is one of the most basic and crucial ones. Various problems can be solved by classification. The feature selection for model setup is extremely important, and producing new features via feature engineering also has a vital place in the success of the model. In our study, fraud detection classification models are built on a labeled and imbalanced dataset as a case-study. Although it is a natural language processing method, a customer space has been created with word embedding, which has been used in different areas, especially for recommender systems. The customer vectors in the created space are fed to the classification model as a feature. Moreover, to increase the number of positive labels, rows with similar characteristics are re-labeled as positive by using customer similarity determined by embedding. The model in which embedding methods are included in the classification, which provides a better representation of customers, has been compared with other models. Considering the results, it is observed that the customer embedding method had a positive effect on the success of the classification models.  ( 2 min )

Recent years have witnessed a rapid development of automated methods for skin lesion diagnosis and classification. Due to an increasing deployment of such systems in clinics, it has become important to develop a more robust system towards various Out-of-Distribution(OOD) samples (unknown skin lesions and conditions). However, the current deep learning models trained for skin lesion classification tend to classify these OOD samples incorrectly into one of their learned skin lesion categories. To address this issue, we propose a simple yet strategic approach that improves the OOD detection performance while maintaining the multi-class classification accuracy for the known categories of skin lesion. To specify, this approach is built upon a realistic scenario of a long-tailed and fine-grained OOD detection task for skin lesion images. Through this approach, 1) First, we target the mixup amongst middle and tail classes to address the long-tail problem. 2) Later, we combine the above mixup strategy with prototype learning to address the fine-grained nature of the dataset. The unique contribution of this paper is two-fold, justified by extensive experiments. First, we present a realistic problem setting of OOD task for skin lesion. Second, we propose an approach to target the long-tailed and fine-grained aspects of the problem setting simultaneously to increase the OOD performance.  ( 3 min )

Helping end users comprehend the abstract distribution shifts can greatly facilitate AI deployment. Motivated by this, we propose a novel task, dataset explanation. Given two image data sets, dataset explanation aims to automatically point out their dataset-level distribution shifts with natural language. Current techniques for monitoring distribution shifts provide inadequate information to understand datasets with the goal of improving data quality. Therefore, we introduce GSCLIP, a training-free framework to solve the dataset explanation task. In GSCLIP, we propose the selector as the first quantitative evaluation method to identify explanations that are proper to summarize dataset shifts. Furthermore, we leverage this selector to demonstrate the superiority of a generator based on language model generation. Systematic evaluation on natural data shift verifies that GSCLIP, a combined system of a hybrid generator group and an efficient selector is not only easy-to-use but also powerful for dataset explanation at scale.  ( 2 min )

Mean-field games (MFGs) are a modeling framework for systems with a large number of interacting agents. They have applications in economics, finance, and game theory. Normalizing flows (NFs) are a family of deep generative models that compute data likelihoods by using an invertible mapping, which is typically parameterized by using neural networks. They are useful for density modeling and data generation. While active research has been conducted on both models, few noted the relationship between the two. In this work, we unravel the connections between MFGs and NFs by contextualizing the training of an NF as solving the MFG. This is achieved by reformulating the MFG problem in terms of agent trajectories and parameterizing a discretization of the resulting MFG with flow architectures. With this connection, we explore two research directions. First, we employ expressive NF architectures to accurately solve high-dimensional MFGs, sidestepping the curse of dimensionality in traditional numerical methods. Compared with other deep learning approaches, our trajectory-based formulation encodes the continuity equation in the neural network, resulting in a better approximation of the population dynamics. Second, we regularize the training of NFs with transport costs and show the effectiveness on controlling the model's Lipschitz bound, resulting in better generalization performance. We demonstrate numerical results through comprehensive experiments on a variety of synthetic and real-life datasets.  ( 3 min )

Cognitive biases are mental shortcuts humans use in dealing with information and the environment, and which result in biased actions and behaviors (or, actions), unbeknownst to themselves. Biases take many forms, with cognitive biases occupying a central role that inflicts fairness, accountability, transparency, ethics, law, medicine, and discrimination. Detection of biases is considered a necessary step toward their mitigation. Herein, we focus on two cognitive biases - anchoring and recency. The recognition of cognitive bias in computer science is largely in the domain of information retrieval, and bias is identified at an aggregate level with the help of annotated data. Proposing a different direction for bias detection, we offer a principled approach along with Machine Learning to detect these two cognitive biases from Web logs of users' actions. Our individual user level detection makes it truly personalized, and does not rely on annotated data. Instead, we start with two basic principles established in cognitive psychology, use modified training of an attention network, and interpret attention weights in a novel way according to those principles, to infer and distinguish between these two biases. The personalized approach allows detection for specific users who are susceptible to these biases when performing their tasks, and can help build awareness among them so as to undertake bias mitigation.  ( 3 min )

Non-negative matrix factorization with transform learning (TL-NMF) is a recent idea that aims at learning data representations suited to NMF. In this work, we relate TL-NMF to the classical matrix joint-diagonalization (JD) problem. We show that, when the number of data realizations is sufficiently large, TL-NMF can be replaced by a two-step approach -- termed as JD+NMF -- that estimates the transform through JD, prior to NMF computation. In contrast, we found that when the number of data realizations is limited, not only is JD+NMF no longer equivalent to TL-NMF, but the inherent low-rank constraint of TL-NMF turns out to be an essential ingredient to learn meaningful transforms for NMF.  ( 2 min )

Randomly initialized wide neural networks transition to linear functions of weights as the width grows, in a ball of radius $O(1)$ around initialization. A necessary condition for this result is that all layers of the network are wide enough, i.e., all widths tend to infinity. However, the transition to linearity breaks down when this infinite width assumption is violated. In this work we show that linear networks with a bottleneck layer learn bilinear functions of the weights, in a ball of radius $O(1)$ around initialization. In general, for $B-1$ bottleneck layers, the network is a degree $B$ multilinear function of weights. Importantly, the degree only depends on the number of bottlenecks and not the total depth of the network.  ( 2 min )

Self-supervised learning representations (SSLR) have resulted in robust features for downstream tasks in many fields. Recently, several SSLRs have shown promising results on automatic speech recognition (ASR) benchmark corpora. However, previous studies have only shown performance for solitary SSLRs as an input feature for ASR models. In this study, we propose to investigate the effectiveness of diverse SSLR combinations using various fusion methods within end-to-end (E2E) ASR models. In addition, we will show there are correlations between these extracted SSLRs. As such, we further propose a feature refinement loss for decorrelation to efficiently combine the set of input features. For evaluation, we show that the proposed 'FeaRLESS learning features' perform better than systems without the proposed feature refinement loss for both the WSJ and Fearless Steps Challenge (FSC) corpora.  ( 2 min )

Humans have the remarkable ability to recognize and acquire novel visual concepts in a zero-shot manner. Given a high-level, symbolic description of a novel concept in terms of previously learned visual concepts and their relations, humans can recognize novel concepts without seeing any examples. Moreover, they can acquire new concepts by parsing and communicating symbolic structures using learned visual concepts and relations. Endowing these capabilities in machines is pivotal in improving their generalization capability at inference time. In this work, we introduce Zero-shot Concept Recognition and Acquisition (ZeroC), a neuro-symbolic architecture that can recognize and acquire novel concepts in a zero-shot way. ZeroC represents concepts as graphs of constituent concept models (as nodes) and their relations (as edges). To allow inference time composition, we employ energy-based models (EBMs) to model concepts and relations. We design ZeroC architecture so that it allows a one-to-one mapping between a symbolic graph structure of a concept and its corresponding EBM, which for the first time, allows acquiring new concepts, communicating its graph structure, and applying it to classification and detection tasks (even across domains) at inference time. We introduce algorithms for learning and inference with ZeroC. We evaluate ZeroC on a challenging grid-world dataset which is designed to probe zero-shot concept recognition and acquisition, and demonstrate its capability.  ( 3 min )

In the context of supervised machine learning a learning curve describes how a model's performance on unseen data relates to the amount of samples used to train the model. In this paper we present a dataset of plant images with representatives of crops and weeds common to the Manitoba prairies at different growth stages. We determine the learning curve for a classification task on this data with the ResNet architecture. Our results are in accordance with previous studies and add to the evidence that learning curves are governed by power-law relationships over large scales, applications, and models. We further investigate how label noise and the reduction of trainable parameters impacts the learning curve on this dataset. Both effects lead to the model requiring disproportionally larger training sets to achieve the same classification performance as observed without these effects.  ( 2 min )

Real-world knowledge graphs (KG) are mostly incomplete. The problem of recovering missing relations, called KG completion, has recently become an active research area. Knowledge graph (KG) embedding, a low-dimensional representation of entities and relations, is the crucial technique for KG completion. Convolutional neural networks in models such as ConvE, SACN, InteractE, and RGCN achieve recent successes. This paper takes a different architectural view and proposes ComDensE which combines relation-aware and common features using dense neural networks. In the relation-aware feature extraction, we attempt to create relational inductive bias by applying an encoding function specific to each relation. In the common feature extraction, we apply the common encoding function to all input embeddings. These encoding functions are implemented using dense layers in ComDensE. ComDensE achieves the state-of-the-art performance in the link prediction in terms of MRR, HIT@1 on FB15k-237 and HIT@1 on WN18RR compared to the previous baseline approaches. We conduct an extensive ablation study to examine the effects of the relation-aware layer and the common layer of the ComDensE. Experimental results illustrate that the combined dense architecture as implemented in ComDensE achieves the best performance.  ( 2 min )

Mixup refers to interpolation-based data augmentation, originally motivated as a way to go beyond empirical risk minimization (ERM). Yet, its extensions focus on the definition of interpolation and the space where it takes place, while the augmentation itself is less studied: For a mini-batch of size $m$, most methods interpolate between $m$ pairs with a single scalar interpolation factor $\lambda$. In this work, we make progress in this direction by introducing MultiMix, which interpolates an arbitrary number $n$ of tuples, each of length $m$, with one vector $\lambda$ per tuple. On sequence data, we further extend to dense interpolation and loss computation over all spatial positions. Overall, we increase the number of tuples per mini-batch by orders of magnitude at little additional cost. This is possible by interpolating at the very last layer before the classifier. Finally, to address inconsistencies due to linear target interpolation, we introduce a self-distillation approach to generate and interpolate synthetic targets. We empirically show that our contributions result in significant improvement over state-of-the-art mixup methods on four benchmarks. By analyzing the embedding space, we observe that the classes are more tightly clustered and uniformly spread over the embedding space, thereby explaining the improved behavior.  ( 2 min )

K-FAC is a successful tractable implementation of Natural Gradient for Deep Learning, which nevertheless suffers from the requirement to compute the inverse of the Kronecker factors (through an eigen-decomposition). This can be very time-consuming (or even prohibitive) when these factors are large. In this paper, we theoretically show that, owing to the exponential-average construction paradigm of the Kronecker factors that is typically used, their eigen-spectrum must decay. We show numerically that in practice this decay is very rapid, leading to the idea that we could save substantial computation by only focusing on the first few eigen-modes when inverting the Kronecker-factors. Randomized Numerical Linear Algebra provides us with the necessary tools to do so. Numerical results show we obtain $\approx2.5\times$ reduction in per-epoch time and $\approx3.3\times$ reduction in time to target accuracy. We compare our proposed K-FAC sped-up versions with a more computationally efficient NG implementation, SENG, and observe we perform on par with it.  ( 2 min )

Invariance has recently proven to be a powerful inductive bias in machine learning models. One such class of predictive or generative models are tensor networks. We introduce a new numerical algorithm to construct a basis of tensors that are invariant under the action of normal matrix representations of an arbitrary discrete group. This method can be up to several orders of magnitude faster than previous approaches. The group-invariant tensors are then combined into a group-invariant tensor train network, which can be used as a supervised machine learning model. We applied this model to a protein binding classification problem, taking into account problem-specific invariances, and obtained prediction accuracy in line with state-of-the-art deep learning approaches.  ( 2 min )

Recent research in deep learning has shown that neural networks can learn differential equations governing dynamical systems. In this paper, we adapt this concept to Virtual Analog (VA) modeling to learn the ordinary differential equations (ODEs) governing the first-order and the second-order diode clipper. The proposed models achieve performance comparable to state-of-the-art recurrent neural networks (RNNs) albeit using fewer parameters. We show that this approach does not require oversampling and allows to increase the sampling rate after the training has completed, which results in increased accuracy. Using a sophisticated numerical solver allows to increase the accuracy at the cost of slower processing. ODEs learned this way do not require closed forms but are still physically interpretable.  ( 2 min )

The size and shape of the receptive field determine how the network aggregates local information and affect the overall performance of a model considerably. Many components in a neural network, such as kernel sizes and strides for convolution and pooling operations, influence the configuration of a receptive field. However, they still rely on hyperparameters, and the receptive fields of existing models result in suboptimal shapes and sizes. Hence, we propose a simple yet effective Dynamically Optimized Pooling operation, referred to as DynOPool, which optimizes the scale factors of feature maps end-to-end by learning the desirable size and shape of its receptive field in each layer. Any kind of resizing modules in a deep neural network can be replaced by the operations with DynOPool at a minimal cost. Also, DynOPool controls the complexity of a model by introducing an additional loss term that constrains computational cost. Our experiments show that the models equipped with the proposed learnable resizing module outperform the baseline networks on multiple datasets in image classification and semantic segmentation.  ( 2 min )

We study the excess capacity of deep networks in the context of supervised classification. That is, given a capacity measure of the underlying hypothesis class -- in our case, empirical Rademacher complexity -- by how much can we (a priori) constrain this class while retaining an empirical error on a par with the unconstrained regime? To assess excess capacity in modern architectures (such as residual networks), we extend and unify prior Rademacher complexity bounds to accommodate function composition and addition, as well as the structure of convolutions. The capacity-driving terms in our bounds are the Lipschitz constants of the layers and a (2,1) group norm distance to the initializations of the convolution weights. Experiments on benchmark datasets of varying task difficulty indicate that (1) there is a substantial amount of excess capacity per task, and (2) capacity can be kept at a surprisingly similar level across tasks. Overall, this suggests a notion of compressibility with respect to weight norms, orthogonal to classic compression via weight pruning.  ( 2 min )

Multi-focus image fusion (MFIF) and super-resolution (SR) are the inverse problem of imaging model, purposes of MFIF and SR are obtaining all-in-focus and high-resolution 2D mapping of targets. Though various MFIF and SR methods have been designed; almost all the them deal with MFIF and SR separately. This paper unifies MFIF and SR problems in the physical perspective as the multi-focus image super resolution fusion (MFISRF), and we propose a novel unified dataset-free unsupervised framework named deep fusion prior (DFP) based-on deep image prior (DIP) to address such MFISRF with single model. Experiments have proved that our proposed DFP approaches or even outperforms those state-of-art MFIF and SR method combinations. To our best knowledge, our proposed work is a dataset-free unsupervised method to simultaneously implement the multi-focus fusion and super-resolution task for the first time. Additionally, DFP is a general framework, thus its networks and focus measurement tactics can be continuously updated to further improve the MFISRF performance. DFP codes are open source available at this http URL  ( 3 min )

As deep learning (DL) efficacy grows, concerns for poor model explainability grow also. Attribution methods address the issue of explainability by quantifying the importance of an input feature for a model prediction. Among various methods, Integrated Gradients (IG) sets itself apart by claiming other methods failed to satisfy desirable axioms, while IG and methods like it uniquely satisfy said axioms. This paper comments on fundamental aspects of IG and its applications/extensions: 1) We identify key differences between IG function spaces and the supporting literature's function spaces which problematize previous claims of IG uniqueness. We show that with the introduction of an additional axiom, \textit{non-decreasing positivity}, the uniqueness claims can be established. 2) We address the question of input sensitivity by identifying function classes where IG is/is not Lipschitz in the attributed input. 3) We show that axioms for single-baseline methods have analogous properties for methods with probability distribution baselines. 4) We introduce a computationally efficient method of identifying internal neurons that contribute to specified regions of an IG attribution map. Finally, we present experimental results validating this method.  ( 2 min )

Pruning neural networks reduces inference time and memory costs. On standard hardware, these benefits will be especially prominent if coarse-grained structures, like feature maps, are pruned. We devise two novel saliency-based methods for second-order structured pruning (SOSP) which include correlations among all structures and layers. Our main method SOSP-H employs an innovative second-order approximation, which enables saliency evaluations by fast Hessian-vector products. SOSP-H thereby scales like a first-order method despite taking into account the full Hessian. We validate SOSP-H by comparing it to our second method SOSP-I that uses a well-established Hessian approximation, and to numerous state-of-the-art methods. While SOSP-H performs on par or better in terms of accuracy, it has clear advantages in terms of scalability and efficiency. This allowed us to scale SOSP-H to large-scale vision tasks, even though it captures correlations across all layers of the network. To underscore the global nature of our pruning methods, we evaluate their performance not only by removing structures from a pretrained network, but also by detecting architectural bottlenecks. We show that our algorithms allow to systematically reveal architectural bottlenecks, which we then remove to further increase the accuracy of the networks.  ( 3 min )

Distributional shift, or the mismatch between training and deployment data, is a significant obstacle to the usage of machine learning in high-stakes industrial applications, such as autonomous driving and medicine. This creates a need to be able to assess how robustly ML models generalize as well as the quality of their uncertainty estimates. Standard ML baseline datasets do not allow these properties to be assessed, as the training, validation and test data are often identically distributed. Recently, a range of dedicated benchmarks have appeared, featuring both distributionally matched and shifted data. Among these benchmarks, the Shifts dataset stands out in terms of the diversity of tasks as well as the data modalities it features. While most of the benchmarks are heavily dominated by 2D image classification tasks, Shifts contains tabular weather forecasting, machine translation, and vehicle motion prediction tasks. This enables the robustness properties of models to be assessed on a diverse set of industrial-scale tasks and either universal or directly applicable task-specific conclusions to be reached. In this paper, we extend the Shifts Dataset with two datasets sourced from industrial, high-risk applications of high societal importance. Specifically, we consider the tasks of segmentation of white matter Multiple Sclerosis lesions in 3D magnetic resonance brain images and the estimation of power consumption in marine cargo vessels. Both tasks feature ubiquitous distributional shifts and a strict safety requirement due to the high cost of errors. These new datasets will allow researchers to further explore robust generalization and uncertainty estimation in new situations. In this work, we provide a description of the dataset and baseline results for both tasks.  ( 3 min )

Advocates for Neuro-Symbolic Artificial Intelligence (NeSy) assert that combining deep learning with symbolic reasoning will lead to stronger AI than either paradigm on its own. As successful as deep learning has been, it is generally accepted that even our best deep learning systems are not very good at abstract reasoning. And since reasoning is inextricably linked to language, it makes intuitive sense that Natural Language Processing (NLP), would be a particularly well-suited candidate for NeSy. We conduct a structured review of studies implementing NeSy for NLP, with the aim of answering the question of whether NeSy is indeed meeting its promises: reasoning, out-of-distribution generalization, interpretability, learning and reasoning from small data, and transferability to new domains. We examine the impact of knowledge representation, such as rules and semantic networks, language structure and relational structure, and whether implicit or explicit reasoning contributes to higher promise scores. We find that systems where logic is compiled into the neural network lead to the most NeSy goals being satisfied, while other factors such as knowledge representation, or type of neural architecture do not exhibit a clear correlation with goals being met. We find many discrepancies in how reasoning is defined, specifically in relation to human level reasoning, which impact decisions about model architectures and drive conclusions which are not always consistent across studies. Hence we advocate for a more methodical approach to the application of theories of human reasoning as well as the development of appropriate benchmarks, which we hope can lead to a better understanding of progress in the field. We make our data and code available on github for further analysis.  ( 3 min )

In optimization for Machine learning (ML), it is typical that curvature-matrix (CM) estimates rely on an exponential average (EA) of local estimates (giving EA-CM algorithms). This approach has little principled justification, but is very often used in practice. In this paper, we draw a connection between EA-CM algorithms and what we call a "Wake of Quadratic regularized models". The outlined connection allows us to understand what EA-CM algorithms are doing from an optimization perspective. Generalizing from the established connection, we propose a new family of algorithms, "KL-Divergence Wake-Regularized Models" (KLD-WRM). We give three different practical instantiations of KLD-WRM, and show numerically that these outperform K-FAC on MNIST.  ( 2 min )

Contrastive learning has proven useful in many applications where access to labelled data is limited. The lack of annotated data is particularly problematic in medical image segmentation as it is difficult to have clinical experts manually annotate large volumes of data such as cardiac structures in ultrasound images of the heart. In this paper, we argue whether or not contrastive pretraining is helpful for the segmentation of the left ventricle in echocardiography images. Furthermore, we study the effect of contrastive pretraining on two well-known segmentation networks, UNet and DeepLabV3. Our results show that contrastive pretraining helps improve the performance on left ventricle segmentation, particularly when annotated data is scarce. We show how to achieve comparable results to state-of-the-art fully supervised algorithms when we train our models in a self-supervised fashion followed by fine-tuning on just 5\% of the data. We show that our solution outperforms what is currently published on a large public dataset (EchoNet-Dynamic) achieving a Dice score of 0.9211. We also compare the performance of our solution on another smaller dataset (CAMUS) to demonstrate the generalizability of our proposed solution. The code is available at (https://github.com/BioMedIA-MBZUAI/contrastive-echo).  ( 3 min )

As one of the most popular machine learning models today, graph neural networks (GNNs) have attracted intense interest recently, and so does their explainability. Users are increasingly interested in a better understanding of GNN models and their outcomes. Unfortunately, today's evaluation frameworks for GNN explainability often rely on synthetic datasets, leading to conclusions of limited scope due to a lack of complexity in the problem instances. As GNN models are deployed to more mission-critical applications, we are in dire need for a common evaluation protocol of explainability methods of GNNs. In this paper, we propose, to our best knowledge, the first systematic evaluation framework for GNN explainability, considering explainability on three different "user needs:" explanation focus, mask nature, and mask transformation. We propose a unique metric that combines the fidelity measures and classify explanations based on their quality of being sufficient or necessary. We scope ourselves to node classification tasks and compare the most representative techniques in the field of input-level explainability for GNNs. For the widely used synthetic benchmarks, surprisingly shallow techniques such as personalized PageRank have the best performance for a minimum computation time. But when the graph structure is more complex and nodes have meaningful features, gradient-based methods, in particular Saliency, are the best according to our evaluation criteria. However, none dominates the others on all evaluation dimensions and there is always a trade-off. We further apply our evaluation protocol in a case study on eBay graphs to reflect the production environment.  ( 3 min )

Recently, the artificial intelligence of things (AIoT) has been gaining increasing attention, with an intriguing vision of providing highly intelligent services through the network connection of things, leading to an advanced AI-driven ecology. However, recent regulatory restrictions on data privacy preclude uploading sensitive local data to data centers and utilizing them in a centralized approach. Directly applying federated learning algorithms in this scenario could hardly meet the industrial requirements of both efficiency and accuracy. Therefore, we propose an efficient industrial federated learning framework for AIoT in terms of a face recognition application. Specifically, we propose to utilize the concept of transfer learning to speed up federated training on devices and further present a novel design of a private projector that helps protect shared gradients without incurring additional memory consumption or computational cost. Empirical studies on a private Asian face dataset show that our approach can achieve high recognition accuracy in only 20 communication rounds, demonstrating its effectiveness in prediction and its efficiency in training.  ( 2 min )

Since the appearance of Covid-19 in late 2019, Covid-19 has become an active research topic for the artificial intelligence (AI) community. One of the most interesting AI topics is Covid-19 analysis of medical imaging. CT-scan imaging is the most informative tool about this disease. This work is part of the 2nd COV19D competition, where two challenges are set: Covid-19 Detection and Covid-19 Severity Detection from the CT-scans. For Covid-19 detection from CT-scans, we proposed an ensemble of 2D Convolution blocks with Densenet-161 models. Here, each 2D convolutional block with Densenet-161 architecture is trained separately and in testing phase, the ensemble model is based on the average of their probabilities. On the other hand, we proposed an ensemble of Convolutional Layers with Inception models for Covid-19 severity detection. In addition to the Convolutional Layers, three Inception variants were used, namely Inception-v3, Inception-v4 and Inception-Resnet. Our proposed approaches outperformed the baseline approach in the validation data of the 2nd COV19D competition by 11% and 16% for Covid-19 detection and Covid-19 severity detection, respectively.  ( 3 min )

Earnings conference calls are attracting an increasing number of researchers due to their free form and rich information. Existing studies, however, do not take speaker role information into account. Furthermore, current research does not fully account for the impact of inter-company relationships on company risk. The only study that integrates company networks and earnings conference calls constructs an undirected graph for companies holding earnings conference calls at different dates, failing to meet the requirement of no temporal information leakage for prediction tasks. To address the aforementioned issues, we propose a new model called Temporal Virtual Graph Neural Network (TVGNN), which incorporates earnings conference calls and company networks to predict company risk. For the first time, our model incorporates participant role information in dialogue modeling. Moreover, we develop a new approach to construct company networks that ensures no temporal information leakage in the graph. In experiments, our proposed model outperforms all baselines. The supplementary analyses demonstrate the model's effectiveness and interpretability.  ( 2 min )

Phase-field modeling is an effective but computationally expensive method for capturing the mesoscale morphological and microstructure evolution in materials. Hence, fast and generalizable surrogate models are needed to alleviate the cost of computationally taxing processes such as in optimization and design of materials. The intrinsic discontinuous nature of the physical phenomena incurred by the presence of sharp phase boundaries makes the training of the surrogate model cumbersome. We develop a framework that integrates a convolutional autoencoder architecture with a deep neural operator (DeepONet) to learn the dynamic evolution of a two-phase mixture and accelerate time-to-solution in predicting the microstructure evolution. We utilize the convolutional autoencoder to provide a compact representation of the microstructure data in a low-dimensional latent space. DeepONet, which consists of two sub-networks, one for encoding the input function at a fixed number of sensors locations (branch net) and another for encoding the locations for the output functions (trunk net), learns the mesoscale dynamics of the microstructure evolution from the autoencoder latent space. The decoder part of the convolutional autoencoder then reconstructs the time-evolved microstructure from the DeepONet predictions. The trained DeepONet architecture can then be used to replace the high-fidelity phase-field numerical solver in interpolation tasks or to accelerate the numerical solver in extrapolation tasks.  ( 3 min )

Neuroimaging techniques produce high-dimensional, stochastic data from which it might be challenging to extract high-level knowledge about the phenomena of interest. We address this challenge by applying the generative modelling framework to 1) classify multiple pathologies and 2) recover the neurological mechanisms of those pathologies in a data-driven manner. Our framework learns generative factors of data related to pathologies. We provide an algorithm to decode those factors further and observe how different pathologies affect observed data. We illustrate the applicability of the proposed approach to identifying schizophrenia, either followed or not by auditory verbal hallucinations. We further demonstrate the ability of the framework to learn disease-related mechanisms consistent with current domain knowledge. We also compare the proposed framework with several benchmark approaches and indicate its classification performance and interpretability advantages.  ( 2 min )

Federated learning is a powerful distributed learning scheme that allows numerous edge devices to collaboratively train a model without sharing their data. However, training is resource-intensive for edge devices, and limited network bandwidth is often the main bottleneck. Prior work often overcomes the constraints by condensing the models or messages into compact formats, e.g., by gradient compression or distillation. In contrast, we propose ProgFed, the first progressive training framework for efficient and effective federated learning. It inherently reduces computation and two-way communication costs while maintaining the strong performance of the final models. We theoretically prove that ProgFed converges at the same asymptotic rate as standard training on full models. Extensive results on a broad range of architectures, including CNNs (VGG, ResNet, ConvNets) and U-nets, and diverse tasks from simple classification to medical image segmentation show that our highly effective training approach saves up to $20\%$ computation and up to $63\%$ communication costs for converged models. As our approach is also complimentary to prior work on compression, we can achieve a wide range of trade-offs by combining these techniques, showing reduced communication of up to $50\times$ at only $0.1\%$ loss in utility. Code is available at https://github.com/a514514772/ProgFed.  ( 3 min )

Since MDLatLRR only considers detailed parts (salient features) of input images extracted by latent low-rank representation (LatLRR), it doesn't use base parts (principal features) extracted by LatLRR effectively. Therefore, we proposed an improved multi-level decomposition method called MDLatLRRv2 which effectively analyzes and utilizes all the image features obtained by LatLRR. Then we apply MDLatLRRv2 to medical image fusion. The base parts are fused by average strategy and the detail parts are fused by nuclear-norm operation. The comparison with the existing methods demonstrates that the proposed method can achieve state-of-the-art fusion performance in objective and subjective assessment.  ( 2 min )

The loss surface of an overparameterized neural network (NN) possesses many global minima of zero training error. We explain how common variants of the standard NN training procedure change the minimizer obtained. First, we make explicit how the size of the initialization of a strongly overparameterized NN affects the minimizer and can deteriorate its final test performance. We propose a strategy to limit this effect. Then, we demonstrate that for adaptive optimization such as AdaGrad, the obtained minimizer generally differs from the gradient descent (GD) minimizer. This adaptive minimizer is changed further by stochastic mini-batch training, even though in the non-adaptive case, GD and stochastic GD result in essentially the same minimizer. Lastly, we explain that these effects remain relevant for less overparameterized NNs. While overparameterization has its benefits, our work highlights that it induces sources of error absent from underparameterized models.  ( 2 min )

As a neurophysiological response to threat or adverse conditions, stress can affect cognition, emotion and behaviour with potentially detrimental effects on health in the case of sustained exposure. Since the affective content of speech is inherently modulated by an individual's physical and mental state, a substantial body of research has been devoted to the study of paralinguistic correlates of stress-inducing task load. Historically, voice stress analysis (VSA) has been conducted using conventional digital signal processing (DSP) techniques. Despite the development of modern methods based on deep neural networks (DNNs), accurately detecting stress in speech remains difficult due to the wide variety of stressors and considerable variability in the individual stress perception. To that end, we introduce a set of five datasets for task load detection in speech. The voice recordings were collected as either cognitive or physical stress was induced in the cohort of volunteers, with a cumulative number of more than a hundred speakers. We used the datasets to design and evaluate a novel self-supervised audio representation that leverages the effectiveness of handcrafted features (DSP-based) and the complexity of data-driven DNN representations. Notably, the proposed approach outperformed both extensive handcrafted feature sets and novel DNN-based audio representation learning approaches.  ( 3 min )

Generalization across different environments with the same tasks is critical for successful applications of visual reinforcement learning (RL) in real scenarios. However, visual distractions -- which are common in real scenes -- from high-dimensional observations can be hurtful to the learned representations in visual RL, thus degrading the performance of generalization. To tackle this problem, we propose a novel approach, namely Characteristic Reward Sequence Prediction (CRESP), to extract the task-relevant information by learning reward sequence distributions (RSDs), as the reward signals are task-relevant in RL and invariant to visual distractions. Specifically, to effectively capture the task-relevant information via RSDs, CRESP introduces an auxiliary task -- that is, predicting the characteristic functions of RSDs -- to learn task-relevant representations, because we can well approximate the high-dimensional distributions by leveraging the corresponding characteristic functions. Experiments demonstrate that CRESP significantly improves the performance of generalization on unseen environments, outperforming several state-of-the-arts on DeepMind Control tasks with different visual distractions.  ( 3 min )

We investigate pneumatic non-prehensile manipulation (i.e., blowing) as a means of efficiently moving scattered objects into a target receptacle. Due to the chaotic nature of aerodynamic forces, a blowing controller must (i) continually adapt to unexpected changes from its actions, (ii) maintain fine-grained control, since the slightest misstep can result in large unintended consequences (e.g., scatter objects already in a pile), and (iii) infer long-range plans (e.g., move the robot to strategic blowing locations). We tackle these challenges in the context of deep reinforcement learning, introducing a multi-frequency version of the spatial action maps framework. This allows for efficient learning of vision-based policies that effectively combine high-level planning and low-level closed-loop control for dynamic mobile manipulation. Experiments show that our system learns efficient behaviors for the task, demonstrating in particular that blowing achieves better downstream performance than pushing, and that our policies improve performance over baselines. Moreover, we show that our system naturally encourages emergent specialization between the different subpolicies spanning low-level fine-grained control and high-level planning. On a real mobile robot equipped with a miniature air blower, we show that our simulation-trained policies transfer well to a real environment and can generalize to novel objects.  ( 3 min )

As the machine learning and systems communities strive to achieve higher energy-efficiency through custom deep neural network (DNN) accelerators, varied precision or quantization levels, and model compression techniques, there is a need for design space exploration frameworks that incorporate quantization-aware processing elements into the accelerator design space while having accurate and fast power, performance, and area models. In this work, we present QUIDAM, a highly parameterized quantization-aware DNN accelerator and model co-exploration framework. Our framework can facilitate future research on design space exploration of DNN accelerators for various design choices such as bit precision, processing element type, scratchpad sizes of processing elements, global buffer size, number of total processing elements, and DNN configurations. Our results show that different bit precisions and processing element types lead to significant differences in terms of performance per area and energy. Specifically, our framework identifies a wide range of design points where performance per area and energy varies more than 5x and 35x, respectively. With the proposed framework, we show that lightweight processing elements achieve on par accuracy results and up to 5.7x more performance per area and energy improvement when compared to the best INT16 based implementation. Finally, due to the efficiency of the pre-characterized power, performance, and area models, QUIDAM can speed up the design exploration process by 3-4 orders of magnitude as it removes the need for expensive synthesis and characterization of each design.  ( 3 min )

This paper studies a transferable phoneme embedding framework that aims to deal with the cross-lingual text-to-speech (TTS) problem under the few-shot setting. Transfer learning is a common approach when it comes to few-shot learning since training from scratch on few-shot training data is bound to overfit. Still, we find that the naive transfer learning approach fails to adapt to unseen languages under extremely few-shot settings, where less than 8 minutes of data is provided. We deal with the problem by proposing a framework that consists of a phoneme-based TTS model and a codebook module to project phonemes from different languages into a learned latent space. Furthermore, by utilizing phoneme-level averaged self-supervised learned features, we effectively improve the quality of synthesized speeches. Experiments show that using 4 utterances, which is about 30 seconds of data, is enough to synthesize intelligible speech when adapting to an unseen language using our framework.

Cut selection is a subroutine used in all modern mixed-integer linear programming solvers with the goal of selecting a subset of generated cuts that induce optimal solver performance. These solvers have millions of parameter combinations, and so are excellent candidates for parameter tuning. Cut selection scoring rules are usually weighted sums of different measurements, where the weights are parameters. We present a parametric family of mixed-integer linear programs together with infinitely many family-wide valid cuts. Some of these cuts can induce integer optimal solutions directly after being applied, while others fail to do so even if an infinite amount are applied. We show for a specific cut selection rule, that any finite grid search of the parameter space will always miss all parameter values, which select integer optimal inducing cuts in an infinite amount of our problems. We propose a variation on the design of existing graph convolutional neural networks, adapting them to learn cut selection rule parameters. We present a reinforcement learning framework for selecting cuts, and train our design using said framework over MIPLIB 2017. Our framework and design show that adaptive cut selection does substantially improve performance over a diverse set of instances, but that finding a single function describing such a rule is difficult. Code for reproducing all experiments is available at https://github.com/Opt-Mucca/Adaptive-Cutsel-MILP.  ( 3 min )

Using a model of the environment and a value function, an agent can construct many estimates of a state's value, by unrolling the model for different lengths and bootstrapping with its value function. Our key insight is that one can treat this set of value estimates as a type of ensemble, which we call an \emph{implicit value ensemble} (IVE). Consequently, the discrepancy between these estimates can be used as a proxy for the agent's epistemic uncertainty; we term this signal \emph{model-value inconsistency} or \emph{self-inconsistency} for short. Unlike prior work which estimates uncertainty by training an ensemble of many models and/or value functions, this approach requires only the single model and value function which are already being learned in most model-based reinforcement learning algorithms. We provide empirical evidence in both tabular and function approximation settings from pixels that self-inconsistency is useful (i) as a signal for exploration, (ii) for acting safely under distribution shifts, and (iii) for robustifying value-based planning with a learned model.  ( 3 min )

Recent contrastive learning methods achieved state-of-the-art in low label regimes. However, the training requires large batch sizes and heavy augmentations to create multiple views of an image. With non-contrastive methods, the negatives are implicitly incorporated in the loss, allowing different images and modalities as pairs. Although the meta-information (i.e., age, sex) in medical imaging is abundant, the annotations are noisy and prone to class imbalance. In this work, we exploited already existing temporal information (different visits from a patient) in a longitudinal optical coherence tomography (OCT) dataset using temporally informed non-contrastive loss (TINC) without increasing complexity and need for negative pairs. Moreover, our novel pair-forming scheme can avoid heavy augmentations and implicitly incorporates the temporal information in the pairs. Finally, these representations learned from the pretraining are more successful in predicting disease progression where the temporal information is crucial for the downstream task. More specifically, our model outperforms existing models in predicting the risk of conversion within a time frame from intermediate age-related macular degeneration (AMD) to the late wet-AMD stage.  ( 2 min )

In this work we study the problem of Subspace Tracking with missing data (ST-miss) and outliers (Robust ST-miss). We propose a novel algorithm, and provide a guarantee for both these problems. Unlike past work on this topic, the current work does not impose the piecewise constant subspace change assumption. Additionally, the proposed algorithm is much simpler (uses fewer parameters) than our previous work. Secondly, we extend our approach and its analysis to provably solving these problems when the data is federated and when the over-air data communication modality is used for information exchange between the $K$ peer nodes and the center. We validate our theoretical claims with extensive numerical experiments.  ( 2 min )

Deep learning on large-scale data is dominant nowadays. The unprecedented scale of data has been arguably one of the most important driving forces for the success of deep learning. However, there still exist scenarios where collecting data or labels could be extremely expensive, e.g., medical imaging and robotics. To fill up this gap, this paper considers the problem of data-efficient learning from scratch using a small amount of representative data. First, we characterize this problem by active learning on homeomorphic tubes of spherical manifolds. This naturally generates feasible hypothesis class. With homologous topological properties, we identify an important connection -- finding tube manifolds is equivalent to minimizing hyperspherical energy (MHE) in physical geometry. Inspired by this connection, we propose a MHE-based active learning (MHEAL) algorithm, and provide comprehensive theoretical guarantees for MHEAL, covering convergence and generalization analysis. Finally, we demonstrate the empirical performance of MHEAL in a wide range of applications on data-efficient learning, including deep clustering, distribution matching, version space sampling and deep active learning.  ( 2 min )

In recent years, the introduction of the Transformer models sparked a revolution in natural language processing (NLP). BERT was one of the first text encoders using only the attention mechanism without any recurrent parts to achieve state-of-the-art results on many NLP tasks. This paper introduces a text classifier using topological data analysis. We use BERT's attention maps transformed into attention graphs as the only input to that classifier. The model can solve tasks such as distinguishing spam from ham messages, recognizing whether a sentence is grammatically correct, or evaluating a movie review as negative or positive. It performs comparably to the BERT baseline and outperforms it on some tasks. Additionally, we propose a new method to reduce the number of BERT's attention heads considered by the topological classifier, which allows us to prune the number of heads from 144 down to as few as ten with no reduction in performance. Our work also shows that the topological model displays higher robustness against adversarial attacks than the original BERT model, which is maintained during the pruning process. To the best of our knowledge, this work is the first to confront topological-based models with adversarial attacks in the context of NLP.  ( 2 min )

Models that generate extractive rationales (i.e., subsets of features) or natural language explanations (NLEs) for their predictions are important for explainable AI. While an extractive rationale provides a quick view of the features most responsible for a prediction, an NLE allows for a comprehensive description of the decision-making process behind a prediction. However, current models that generate the best extractive rationales or NLEs often fall behind the state-of-the-art (SOTA) in terms of task performance. In this work, we bridge this gap by introducing RExC, a self-rationalizing framework that grounds its predictions and two complementary types of explanations (NLEs and extractive rationales) in background knowledge. Our framework improves over previous methods by: (i) reaching SOTA task performance while also providing explanations, (ii) providing two types of explanations, while existing models usually provide only one type, and (iii) beating by a large margin the previous SOTA in terms of quality of both types of explanations. Furthermore, a perturbation analysis in RExC shows a high degree of association between explanations and predictions, a necessary property of faithful explanations.  ( 3 min )

Traditional approaches based on finite element analyses have been successfully used to predict the macro-scale behavior of heterogeneous materials (composites, multicomponent alloys, and polycrystals) widely used in industrial applications. However, this necessitates the mesh size to be smaller than the characteristic length scale of the microstructural heterogeneities in the material leading to computationally expensive and time-consuming calculations. The recent advances in deep learning based image super-resolution (SR) algorithms open up a promising avenue to tackle this computational challenge by enabling researchers to enhance the spatio-temporal resolution of data obtained from coarse mesh simulations. However, technical challenges still remain in developing a high-fidelity SR model for application to computational solid mechanics, especially for materials undergoing large deformation. This work aims at developing a physics-informed deep learning based super-resolution framework (PhySRNet) which enables reconstruction of high-resolution deformation fields (displacement and stress) from their low-resolution counterparts without requiring high-resolution labeled data. We design a synthetic case study to illustrate the effectiveness of the proposed framework and demonstrate that the super-resolved fields match the accuracy of an advanced numerical solver running at 400 times the coarse mesh resolution while simultaneously satisfying the (highly nonlinear) governing laws. The approach opens the door to applying machine learning and traditional numerical approaches in tandem to reduce computational complexity accelerate scientific discovery and engineering design.

Understanding generalization in modern machine learning settings has been one of the major challenges in statistical learning theory. In this context, recent years have witnessed the development of various generalization bounds suggesting different complexity notions such as the mutual information between the data sample and the algorithm output, compressibility of the hypothesis space, and the fractal dimension of the hypothesis space. While these bounds have illuminated the problem at hand from different angles, their suggested complexity notions might appear seemingly unrelated, thereby restricting their high-level impact. In this study, we prove novel generalization bounds through the lens of rate-distortion theory, and explicitly relate the concepts of mutual information, compressibility, and fractal dimensions in a single mathematical framework. Our approach consists of (i) defining a generalized notion of compressibility by using source coding concepts, and (ii) showing that the `compression error rate' can be linked to the generalization error both in expectation and with high probability. We show that in the `lossless compression' setting, we recover and improve existing mutual information-based bounds, whereas a `lossy compression' scheme allows us to link generalization to the rate-distortion dimension -- a particular notion of fractal dimension. Our results bring a more unified perspective on generalization and open up several future research directions.  ( 3 min )

Telehealth helps to facilitate access to medical professionals by enabling remote medical services for the patients. These services have become gradually popular over the years with the advent of necessary technological infrastructure. The benefits of telehealth have been even more apparent since the beginning of the COVID-19 crisis, as people have become less inclined to visit doctors in person during the pandemic. In this paper, we focus on facilitating the chat sessions between a doctor and a patient. We note that the quality and efficiency of the chat experience can be critical as the demand for telehealth services increases. Accordingly, we develop a smart auto-response generation mechanism for medical conversations that helps doctors respond to consultation requests efficiently, particularly during busy sessions. We explore over 900,000 anonymous, historical online messages between doctors and patients collected over nine months. We implement clustering algorithms to identify the most frequent responses by doctors and manually label the data accordingly. We then train machine learning algorithms using this preprocessed data to generate the responses. The considered algorithm has two steps: a filtering (i.e., triggering) model to filter out infeasible patient messages and a response generator to suggest the top-3 doctor responses for the ones that successfully pass the triggering phase. The method provides an accuracy of 83.28\% for precision@3 and shows robustness to its parameters.  ( 3 min )

Computational learning approaches to solving visual reasoning tests, such as Raven's Progressive Matrices (RPM), critically depend on the ability to identify the visual concepts used in the test (i.e., the representation) as well as the latent rules based on those concepts (i.e., the reasoning). However, learning of representation and reasoning is a challenging and ill-posed task, often approached in a stage-wise manner (first representation, then reasoning). In this work, we propose an end-to-end joint representation-reasoning learning framework, which leverages a weak form of inductive bias to improve both tasks together. Specifically, we introduce a general generative graphical model for RPMs, GM-RPM, and apply it to solve the reasoning test. We accomplish this using a novel learning framework Disentangling based Abstract Reasoning Network (DAReN) based on the principles of GM-RPM. We perform an empirical evaluation of DAReN over several benchmark datasets. DAReN shows consistent improvement over state-of-the-art (SOTA) models on both the reasoning and the disentanglement tasks. This demonstrates the strong correlation between disentangled latent representation and the ability to solve abstract visual reasoning tasks.  ( 2 min )

Wasserstein GANs with Gradient Penalty (WGAN-GP) are a very popular method for training generative models to produce high quality synthetic data. While WGAN-GP were initially developed to calculate the Wasserstein 1 distance between generated and real data, recent works (e.g. [23]) have provided empirical evidence that this does not occur, and have argued that WGAN-GP perform well not in spite of this issue, but because of it. In this paper we show for the first time that WGAN-GP compute the minimum of a different optimal transport problem, the so-called congested transport [7]. Congested transport determines the cost of moving one distribution to another under a transport model that penalizes congestion. For WGAN-GP, we find that the congestion penalty has a spatially varying component determined by the sampling strategy used in [12] which acts like a local speed limit, making congestion cost less in some regions than others. This aspect of the congested transport problem is new, in that the congestion penalty turns out to be unbounded and depends on the distributions to be transported, and so we provide the necessary mathematical proofs for this setting. One facet of our discovery is a formula connecting the gradient of solutions to the optimization problem in WGAN-GP to the time averaged momentum of the optimal mass flow. This is in contrast to the gradient of Kantorovich potentials for the Wasserstein 1 distance, which is just the normalized direction of flow. Based on this and other considerations, we speculate on how our results explain the observed performance of WGAN-GP. Beyond applications to GANs, our theorems also point to the possibility of approximately solving large scale congested transport problems using neural network techniques.  ( 3 min )

Realistic manipulation tasks require a robot to interact with an environment with a prolonged sequence of motor actions. While deep reinforcement learning methods have recently emerged as a promising paradigm for automating manipulation behaviors, they usually fall short in long-horizon tasks due to the exploration burden. This work introduces Manipulation Primitive-augmented reinforcement Learning (MAPLE), a learning framework that augments standard reinforcement learning algorithms with a pre-defined library of behavior primitives. These behavior primitives are robust functional modules specialized in achieving manipulation goals, such as grasping and pushing. To use these heterogeneous primitives, we develop a hierarchical policy that involves the primitives and instantiates their executions with input parameters. We demonstrate that MAPLE outperforms baseline approaches by a significant margin on a suite of simulated manipulation tasks. We also quantify the compositional structure of the learned behaviors and highlight our method's ability to transfer policies to new task variants and to physical hardware. Videos and code are available at https://ut-austin-rpl.github.io/maple  ( 2 min )

Model selection in contextual bandits is an important complementary problem to regret minimization with respect to a fixed model class. We consider the simplest non-trivial instance of model-selection: distinguishing a simple multi-armed bandit problem from a linear contextual bandit problem. Even in this instance, current state-of-the-art methods explore in a suboptimal manner and require strong "feature-diversity" conditions. In this paper, we introduce new algorithms that a) explore in a data-adaptive manner, and b) provide model selection guarantees of the form $\mathcal{O}(d^{\alpha} T^{1- \alpha})$ with no feature diversity conditions whatsoever, where $d$ denotes the dimension of the linear model and $T$ denotes the total number of rounds. The first algorithm enjoys a "best-of-both-worlds" property, recovering two prior results that hold under distinct distributional assumptions, simultaneously. The second removes distributional assumptions altogether, expanding the scope for tractable model selection. Our approach extends to model selection among nested linear contextual bandits under some additional assumptions.  ( 2 min )

Many modern machine learning algorithms such as generative adversarial networks (GANs) and adversarial training can be formulated as minimax optimization. Gradient descent ascent (GDA) is the most commonly used algorithm due to its simplicity. However, GDA can converge to non-optimal minimax points. We propose a new minimax optimization framework, GDA-AM, that views the GDAdynamics as a fixed-point iteration and solves it using Anderson Mixing to con-verge to the local minimax. It addresses the diverging issue of simultaneous GDAand accelerates the convergence of alternating GDA. We show theoretically that the algorithm can achieve global convergence for bilinear problems under mild conditions. We also empirically show that GDA-AMsolves a variety of minimax problems and improves GAN training on several datasets  ( 2 min )

Human learners can readily understand speech, or a melody, when it is presented slower or faster than usual. Although deep convolutional neural networks (CNNs) are extremely powerful in extracting information from time series, they require explicit training to generalize to different time scales. This paper presents a deep CNN that incorporates a temporal representation inspired by recent findings from neuroscience. In the mammalian brain, time is represented by populations of neurons with temporal receptive fields. Critically, the peaks of the receptive fields form a geometric series, such that the population codes a set of temporal basis functions over log time. Because memory for the recent past is a function of log time, rescaling the input results in translation of the memory. The Scale-Invariant Temporal History Convolution network (SITHCon) builds a convolutional layer over this logarithmically-distributed temporal memory. A max-pool operation results in a network that is invariant to rescalings of time modulo edge effects. We compare performance of SITHCon to a Temporal Convolution Network (TCN). Although both networks can learn classification and regression problems on both univariate and multivariate time series f(t), only SITHCon generalizes to rescalings f(at). This property, inspired by findings from contemporary neuroscience and consistent with findings from cognitive psychology, may enable networks that learn with fewer training examples, fewer weights and that generalize more robustly to out of sample data.  ( 3 min )

Identification of nonlinear dynamic systems remains a significant challenge across engineering. This work suggests an approach based on Bayesian filtering to extract and identify the contribution of an unknown nonlinear term in the system which can be seen as an alternative viewpoint on restoring force surface type approaches. To achieve this identification, the contribution which is the nonlinear restoring force is modelled, initially, as a Gaussian process in time. That Gaussian process is converted into a state-space model and combined with the linear dynamic component of the system. Then, by inference of the filtering and smoothing distributions, the internal states of the system and the nonlinear restoring force can be extracted. In possession of these states a nonlinear model can be constructed. The approach is demonstrated to be effective in both a simulated case study and on an experimental benchmark dataset.  ( 2 min )

Prompt tuning is an emerging way of adapting pre-trained language models to downstream tasks. However, the existing studies are mainly to add prompts to the input sequence. This way would not work as expected due to the intermediate multi-head self-attention and feed-forward network computation, making model optimization not very smooth. Hence, we propose a novel tuning way called layer tuning, aiming to add learnable parameters in Transformer layers. Specifically, we focus on layer tuning for feed-forward network in the Transformer, namely FL-tuning. It introduces additional units into the hidden layer of each feed-forward network. We conduct extensive experiments on the public CLUE benchmark. The results show that: 1) Our FL-tuning outperforms prompt tuning methods under both full-data and few-shot settings in almost all cases. In particular, it improves accuracy by 17.93% (full-data setting) on WSC 1.0 and F1 by 16.142% (few-shot setting) on CLUENER over P-tuning v2. 2) Our FL-tuning is more stable and converges about 1.17 times faster than P-tuning v2. 3) With only about 3% of Transformer's parameters to be trained, FL-tuning is comparable with fine-tuning on most datasets, and significantly outperforms fine-tuning (e.g., accuracy improved by 12.9% on WSC 1.1) on several datasets. The source codes are available at https://github.com/genggui001/FL-Tuning.  ( 2 min )

Our world is full of asymmetries. Gravity and wind can make reaching a place easier than coming back. Social artifacts such as genealogy charts and citation graphs are inherently directed. In reinforcement learning and control, optimal goal-reaching strategies are rarely reversible (symmetrical). Distance functions supported on these asymmetrical structures are called quasimetrics. Despite their common appearance, little research has been done on the learning of quasimetrics. Our theoretical analysis reveals that a common class of learning algorithms, including unconstrained multilayer perceptrons (MLPs), provably fails to learn a quasimetric consistent with training data. In contrast, our proposed Poisson Quasimetric Embedding (PQE) is the first quasimetric learning formulation that both is learnable with gradient-based optimization and enjoys strong performance guarantees. Experiments on random graphs, social graphs, and offline Q-learning demonstrate its effectiveness over many common baselines.  ( 2 min )

We present a single-stage casual waveform-to-waveform multichannel model that can separate moving sound sources based on their broad spatial locations in a dynamic acoustic scene. We divide the scene into two spatial regions containing, respectively, the target and the interfering sound sources. The model is trained end-to-end and performs spatial processing implicitly, without any components based on traditional processing or use of hand-crafted spatial features. We evaluate the proposed model on a real-world dataset and show that the model matches the performance of an oracle beamformer followed by a state-of-the-art single-channel enhancement network.

A common classification task situation is where one has a large amount of data available for training, but only a small portion is annotated with class labels. The goal of semi-supervised training, in this context, is to improve classification accuracy by leverage information not only from labeled data but also from a large amount of unlabeled data. Recent works have developed significant improvements by exploring the consistency constrain between differently augmented labeled and unlabeled data. Following this path, we propose a novel unsupervised objective that focuses on the less studied relationship between the high confidence unlabeled data that are similar to each other. The new proposed Pair Loss minimizes the statistical distance between high confidence pseudo labels with similarity above a certain threshold. Combining the Pair Loss with the techniques developed by the MixMatch family, our proposed SimPLE algorithm shows significant performance gains over previous algorithms on CIFAR-100 and Mini-ImageNet, and is on par with the state-of-the-art methods on CIFAR-10 and SVHN. Furthermore, SimPLE also outperforms the state-of-the-art methods in the transfer learning setting, where models are initialized by the weights pre-trained on ImageNet or DomainNet-Real. The code is available at github.com/zijian-hu/SimPLE.  ( 3 min )

The human annotations are imperfect, especially when produced by junior practitioners. Multi-expert consensus is usually regarded as golden standard, while this annotation protocol is too expensive to implement in many real-world projects. In this study, we propose a method to refine human annotation, named Neural Annotation Refinement (NeAR). It is based on a learnable implicit function, which decodes a latent vector into represented shape. By integrating the appearance as an input of implicit functions, the appearance-aware NeAR fixes the annotation artefacts. Our method is demonstrated on the application of adrenal gland analysis. We first show that the NeAR can repair distorted golden standards on a public adrenal gland segmentation dataset. Besides, we develop a new Adrenal gLand ANalysis (ALAN) dataset with the proposed NeAR, where each case consists of a 3D shape of adrenal gland and its diagnosis label (normal vs. abnormal) assigned by experts. We show that models trained on the shapes repaired by the NeAR can diagnose adrenal glands better than the original ones. The ALAN dataset will be open-source, with 1,594 shapes for adrenal gland diagnosis, which serves as a new benchmark for medical shape analysis. Code and dataset are available at https://github.com/M3DV/NeAR.  ( 3 min )

The recent spike in certified Artificial Intelligence (AI) tools for healthcare has renewed the debate around adoption of this technology. One thread of such debate concerns Explainable AI and its promise to render AI devices more transparent and trustworthy. A few voices active in the medical AI space have expressed concerns on the reliability of Explainable AI techniques, questioning their use and inclusion in guidelines and standards. Revisiting such criticisms, this article offers a balanced and comprehensive perspective on the utility of Explainable AI, focusing on the specificity of clinical applications of AI and placing them in the context of healthcare interventions. Against its detractors and despite valid concerns, we argue that the Explainable AI research program is still central to human-machine interaction and ultimately our main tool against loss of control, a danger that cannot be prevented by rigorous clinical validation alone.

The second-order optimization methods, notably the D-KFAC (Distributed Kronecker Factored Approximate Curvature) algorithms, have gained traction on accelerating deep neural network (DNN) training on GPU clusters. However, existing D-KFAC algorithms require to compute and communicate a large volume of second-order information, i.e., Kronecker factors (KFs), before preconditioning gradients, resulting in large computation and communication overheads as well as a high memory footprint. In this paper, we propose DP-KFAC, a novel distributed preconditioning scheme that distributes the KF constructing tasks at different DNN layers to different workers. DP-KFAC not only retains the convergence property of the existing D-KFAC algorithms but also enables three benefits: reduced computation overhead in constructing KFs, no communication of KFs, and low memory footprint. Extensive experiments on a 64-GPU cluster show that DP-KFAC reduces the computation overhead by 1.55x-1.65x, the communication cost by 2.79x-3.15x, and the memory footprint by 1.14x-1.47x in each second-order update compared to the state-of-the-art D-KFAC methods.

Devising and analyzing learning models for spatiotemporal network data is of importance for tasks including forecasting, anomaly detection, and multi-agent coordination, among others. Graph Convolutional Neural Networks (GCNNs) are an established approach to learn from time-invariant network data. The graph convolution operation offers a principled approach to aggregate multiresolution information. However, extending the convolution principled learning and respective analysis to the spatiotemporal domain is challenging because spatiotemporal data have more intrinsic dependencies. Hence, a higher flexibility to capture jointly the spatial and the temporal dependencies is required to learn meaningful higher-order representations. Here, we leverage product graphs to represent the spatiotemporal dependencies in the data and introduce Graph-Time Convolutional Neural Networks (GTCNNs) as a principled architecture to aid learning. The proposed approach can work with any type of product graph and we also introduce a parametric product graph to learn also the spatiotemporal coupling. The convolution principle further allows a similar mathematical tractability as for GCNNs. In particular, the stability result shows GTCNNs are stable to spatial perturbations but there is an implicit trade-off between discriminability and robustness; i.e., the more complex the model, the less stable. Extensive numerical results on benchmark datasets corroborate our findings and show the GTCNN compares favorably with state-of-the-art solutions. We anticipate the GTCNN to be a starting point for more sophisticated models that achieve good performance but are also fundamentally grounded.

Representation learning has become a practical family of methods for building rich parametric codifications of massive high-dimensional data while succeeding in the reconstruction side. When considering unsupervised tasks with test-train distribution shifts, the probabilistic viewpoint helps for addressing overconfidence and poor calibration of predictions. However, the direct introduction of Bayesian inference on top of neural networks weights is still an ardous problem for multiple reasons, i.e. the curse of dimensionality or intractability issues. The Laplace approximation (LA) offers a solution here, as one may build Gaussian approximations of the posterior density of weights via second-order Taylor expansions in certain locations of the parameter space. In this work, we present a Bayesian autoencoder for unsupervised representation learning inspired in LA. Our method implements iterative Laplace updates to obtain a novel variational lower-bound of the autoencoder evidence. The vast computational burden of the second-order partial derivatives is skipped via approximations of the Hessian matrix. Empirically, we demonstrate the scalability and performance of the Laplacian autoencoder by providing well-calibrated uncertainties for out-of-distribution detection, geodesics for differential geometry and missing data imputations.

Besides standard cameras, autonomous vehicles typically include multiple additional sensors, such as lidars and radars, which help acquire richer information for perceiving the content of the driving scene. While several recent works focus on fusing certain pairs of sensors - such as camera and lidar or camera and radar - by using architectural components specific to the examined setting, a generic and modular sensor fusion architecture is missing from the literature. In this work, we focus on 2D object detection, a fundamental high-level task which is defined on the 2D image domain, and propose HRFuser, a multi-resolution sensor fusion architecture that scales straightforwardly to an arbitrary number of input modalities. The design of HRFuser is based on state-of-the-art high-resolution networks for image-only dense prediction and incorporates a novel multi-window cross-attention block as the means to perform fusion of multiple modalities at multiple resolutions. Even though cameras alone provide very informative features for 2D detection, we demonstrate via extensive experiments on the nuScenes and Seeing Through Fog datasets that our model effectively leverages complementary features from additional modalities, substantially improving upon camera-only performance and consistently outperforming state-of-the-art fusion methods for 2D detection both in normal and adverse conditions. The source code will be made publicly available.

Finding equilibria points in continuous minimax games has become a key problem within machine learning, in part due to its connection to the training of generative adversarial networks. Because of existence and robustness issues, recent developments have shifted from pure equilibria to focusing on mixed equilibria points. In this note we consider a method proposed by Domingo-Enrich et al. for finding mixed equilibria in two-layer zero-sum games. The method is based on entropic regularisation and the two competing strategies are represented by two sets of interacting particles. We show that the sequence of empirical measures of the particle system satisfies a large deviation principle as the number of particles grows to infinity, and how this implies convergence of the empirical measure and the associated Nikaid\^o-Isoda error, complementing existing law of large numbers results.

We study the problem of learning the parameters for the Hamiltonian of a quantum many-body system, given limited access to the system. In this work, we build upon recent approaches to Hamiltonian learning via derivative estimation. We propose a protocol that improves the scaling dependence of prior works, particularly with respect to parameters relating to the structure of the Hamiltonian (e.g., its locality $k$). Furthermore, by deriving exact bounds on the performance of our protocol, we are able to provide a precise numerical prescription for theoretically optimal settings of hyperparameters in our learning protocol, such as the maximum evolution time (when learning with unitary dynamics) or minimum temperature (when learning with Gibbs states). Thanks to these improvements, our protocol is practical for large problems: we demonstrate this with a numerical simulation of our protocol on an 80-qubit system.

Significant theoretical work has established that in specific regimes, neural networks trained by gradient descent behave like kernel methods. However, in practice, it is known that neural networks strongly outperform their associated kernels. In this work, we explain this gap by demonstrating that there is a large class of functions which cannot be efficiently learned by kernel methods but can be easily learned with gradient descent on a two layer neural network outside the kernel regime by learning representations that are relevant to the target task. We also demonstrate that these representations allow for efficient transfer learning, which is impossible in the kernel regime. Specifically, we consider the problem of learning polynomials which depend on only a few relevant directions, i.e. of the form $f^\star(x) = g(Ux)$ where $U: \R^d \to \R^r$ with $d \gg r$. When the degree of $f^\star$ is $p$, it is known that $n \asymp d^p$ samples are necessary to learn $f^\star$ in the kernel regime. Our primary result is that gradient descent learns a representation of the data which depends only on the directions relevant to $f^\star$. This results in an improved sample complexity of $n\asymp d^2 r + dr^p$. Furthermore, in a transfer learning setup where the data distributions in the source and target domain share the same representation $U$ but have different polynomial heads we show that a popular heuristic for transfer learning has a target sample complexity independent of $d$.

Most of the existing methods for estimating the local intrinsic dimension of a data distribution do not scale well to high-dimensional data. Many of them rely on a non-parametric nearest neighbors approach which suffers from the curse of dimensionality. We attempt to address that challenge by proposing a novel approach to the problem: Local Intrinsic Dimension estimation using approximate Likelihood (LIDL). Our method relies on an arbitrary density estimation method as its subroutine and hence tries to sidestep the dimensionality challenge by making use of the recent progress in parametric neural methods for likelihood estimation. We carefully investigate the empirical properties of the proposed method, compare them with our theoretical predictions, and show that LIDL yields competitive results on the standard benchmarks for this problem and that it scales to thousands of dimensions. What is more, we anticipate this approach to improve further with the continuing advances in the density estimation literature.

Anomaly detection in multivariate time series plays an important role in monitoring the behaviors of various real-world systems, e.g., IT system operations or manufacturing industry. Previous approaches model the joint distribution without considering the underlying mechanism of multivariate time series, making them complicated and computationally hungry. In this paper, we formulate the anomaly detection problem from a causal perspective and view anomalies as instances that do not follow the regular causal mechanism to generate the multivariate data. We then propose a causality-based anomaly detection approach, which first learns the causal structure from data and then infers whether an instance is an anomaly relative to the local causal mechanism to generate each variable from its direct causes, whose conditional distribution can be directly estimated from data. In light of the modularity property of causal systems, the original problem is divided into a series of separate low-dimensional anomaly detection problems so that where an anomaly happens can be directly identified. We evaluate our approach with both simulated and public datasets as well as a case study on real-world AIOps applications, showing its efficacy, robustness, and practical feasibility.

Previous Part-Of-Speech (POS) induction models usually assume certain independence assumptions (e.g., Markov, unidirectional, local dependency) that do not hold in real languages. For example, the subject-verb agreement can be both long-term and bidirectional. To facilitate flexible dependency modeling, we propose a Masked Part-of-Speech Model (MPoSM), inspired by the recent success of Masked Language Models (MLM). MPoSM can model arbitrary tag dependency and perform POS induction through the objective of masked POS reconstruction. We achieve competitive results on both the English Penn WSJ dataset as well as the universal treebank containing 10 diverse languages. Though modeling the long-term dependency should ideally help this task, our ablation study shows mixed trends in different languages. To better understand this phenomenon, we design a novel synthetic experiment that can specifically diagnose the model's ability to learn tag agreement. Surprisingly, we find that even strong baselines fail to solve this problem consistently in a very simplified setting: the agreement between adjacent words. Nonetheless, MPoSM achieves overall better performance. Lastly, we conduct a detailed error analysis to shed light on other remaining challenges. Our code is available at https://github.com/owenzx/MPoSM  ( 2 min )

Nowadays, Breast cancer has risen to become one of the most prominent causes of death in recent years. Among all malignancies, this is the most frequent and the major cause of death for women globally. Manually diagnosing this disease requires a good amount of time and expertise. Breast cancer detection is time-consuming, and the spread of the disease can be reduced by developing machine-based breast cancer predictions. In Machine learning, the system can learn from prior instances and find hard-to-detect patterns from noisy or complicated data sets using various statistical, probabilistic, and optimization approaches. This work compares several machine learning algorithm's classification accuracy, precision, sensitivity, and specificity on a newly collected dataset. In this work Decision tree, Random Forest, Logistic Regression, Naive Bayes, and XGBoost, these five machine learning approaches have been implemented to get the best performance on our dataset. This study focuses on finding the best algorithm that can forecast breast cancer with maximum accuracy in terms of its classes. This work evaluated the quality of each algorithm's data classification in terms of efficiency and effectiveness. And also compared with other published work on this domain. After implementing the model, this study achieved the best model accuracy, 94% on Random Forest and XGBoost.  ( 3 min )

Generative adversarial networks (GANs) have proven to be surprisingly efficient for image editing by inverting and manipulating the latent code corresponding to an input real image. This editing property emerges from the disentangled nature of the latent space. In this paper, we identify that the facial attribute disentanglement is not optimal, thus facial editing relying on linear attribute separation is flawed. We thus propose to improve semantic disentanglement with supervision. Our method consists in learning a proxy latent representation using normalizing flows, and we show that this leads to a more efficient space for face image editing.  ( 2 min )

Bilevel optimization has been applied to a wide variety of machine learning models. Numerous stochastic bilevel optimization algorithms have been developed in recent years. However, most of them restrict their focus on the single-machine setting so that they are incapable of handling the distributed data. To address this issue, under the setting where all participants compose a network and perform the peer-to-peer communication in this network, we developed two novel distributed stochastic bilevel optimization algorithms based on the gradient tracking communication mechanism and two different gradient estimators. Additionally, we show that they can achieve $O(\frac{1}{\epsilon^{2}(1-\lambda)^2})$ and $O(\frac{1}{\epsilon^{3/2}(1-\lambda)^2})$ convergence rate respectively to obtain the $\epsilon$-accuracy solution, where $1-\lambda$ denotes the spectral gap of the communication network. To our knowledge, this is the first work achieving these theoretical results. Finally, we applied our algorithms to practical machine learning models, and the experimental results confirmed the efficacy of our algorithms.  ( 2 min )

We study the problem of model selection in bandit scenarios in the presence of nested policy classes, with the goal of obtaining simultaneous adversarial and stochastic ("best of both worlds") high-probability regret guarantees. Our approach requires that each base learner comes with a candidate regret bound that may or may not hold, while our meta algorithm plays each base learner according to a schedule that keeps the base learner's candidate regret bounds balanced until they are detected to violate their guarantees. We develop careful mis-specification tests specifically designed to blend the above model selection criterion with the ability to leverage the (potentially benign) nature of the environment. We recover the model selection guarantees of the CORRAL algorithm for adversarial environments, but with the additional benefit of achieving high probability regret bounds, specifically in the case of nested adversarial linear bandits. More importantly, our model selection results also hold simultaneously in stochastic environments under gap assumptions. These are the first theoretical results that achieve best of both world (stochastic and adversarial) guarantees while performing model selection in (linear) bandit scenarios.  ( 2 min )

Traffic demand forecasting by deep neural networks has attracted widespread interest in both academia and industry society. Among them, the pairwise Origin-Destination (OD) demand prediction is a valuable but challenging problem due to several factors: (i) the large number of possible OD pairs, (ii) implicitness of spatial dependence, and (iii) complexity of traffic states. To address the above issues, this paper proposes a Continuous-time and Multi-level dynamic graph representation learning method for Origin-Destination demand prediction (CMOD). Firstly, a continuous-time dynamic graph representation learning framework is constructed, which maintains a dynamic state vector for each traffic node (metro stations or taxi zones). The state vectors keep historical transaction information and are continuously updated according to the most recently happened transactions. Secondly, a multi-level structure learning module is proposed to model the spatial dependency of station-level nodes. It can not only exploit relations between nodes adaptively from data, but also share messages and representations via cluster-level and area-level virtual nodes. Lastly, a cross-level fusion module is designed to integrate multi-level memories and generate comprehensive node representations for the final prediction. Extensive experiments are conducted on two real-world datasets from Beijing Subway and New York Taxi, and the results demonstrate the superiority of our model against the state-of-the-art approaches.  ( 3 min )

The expressive and computationally inexpensive bipartite Graph Neural Networks (GNN) have been shown to be an important component of deep learning based Mixed-Integer Linear Program (MILP) solvers. Recent works have demonstrated the effectiveness of such GNNs in replacing the branching (variable selection) heuristic in branch-and-bound (B&B) solvers. These GNNs are trained, offline and on a collection of MILPs, to imitate a very good but computationally expensive branching heuristic, strong branching. Given that B&B results in a tree of sub-MILPs, we ask (a) whether there are strong dependencies exhibited by the target heuristic among the neighboring nodes of the B&B tree, and (b) if so, whether we can incorporate them in our training procedure. Specifically, we find that with the strong branching heuristic, a child node's best choice was often the parent's second-best choice. We call this the "lookback" phenomenon. Surprisingly, the typical branching GNN of Gasse et al. (2019) often misses this simple "answer". To imitate the target behavior more closely by incorporating the lookback phenomenon in GNNs, we propose two methods: (a) target smoothing for the standard cross-entropy loss function, and (b) adding a Parent-as-Target (PAT) Lookback regularizer term. Finally, we propose a model selection framework to incorporate harder-to-formulate objectives such as solving time in the final models. Through extensive experimentation on standard benchmark instances, we show that our proposal results in up to 22% decrease in the size of the B&B tree and up to 15% improvement in the solving times.  ( 3 min )

This work seeks to center validity considerations in deliberations around whether and how to build data-driven algorithms in high-stakes domains. Toward this end, we translate key concepts from validity theory to predictive algorithms. We describe common challenges in problem formulation and data issues that jeopardize the validity of predictive algorithms. We distill these issues into a series of high-level questions intended to promote and document reflections on the legitimacy of the predictive task and the suitability of the data. This contribution lays the foundation for co-designing a validity protocol, in collaboration with real-world stakeholders, including decision-makers, modelers, and members of potentially impacted communities, to critically evaluate the justifiability of specific designs and uses of data-driven algorithmic systems.  ( 2 min )

Here, we present a method called Manifold Interpolating Optimal-Transport Flow (MIOFlow) that learns stochastic, continuous population dynamics from static snapshot samples taken at sporadic timepoints. MIOFlow combines dynamic models, manifold learning, and optimal transport by training neural ordinary differential equations (Neural ODE) to interpolate between static population snapshots as penalized by optimal transport with manifold ground distance. Further, we ensure that the flow follows the geometry by operating in the latent space of an autoencoder that we call a geodesic autoencoder (GAE). In GAE the latent space distance between points is regularized to match a novel multiscale geodesic distance on the data manifold that we define. We show that this method is superior to normalizing flows, Schr\"odinger bridges and other generative models that are designed to flow from noise to data in terms of interpolating between populations. Theoretically, we link these trajectories with dynamic optimal transport. We evaluate our method on simulated data with bifurcations and merges, as well as scRNA-seq data from embryoid body differentiation, and acute myeloid leukemia treatment.  ( 2 min )

Semi-Supervised Learning (SSL) is fundamentally a missing label problem, in which the label Missing Not At Random (MNAR) problem is more realistic and challenging, compared to the widely-adopted yet naive Missing Completely At Random assumption where both labeled and unlabeled data share the same class distribution. Different from existing SSL solutions that overlook the role of "class" in causing the non-randomness, e.g., users are more likely to label popular classes, we explicitly incorporate "class" into SSL. Our method is three-fold: 1) We propose Class-Aware Propensity (CAP) that exploits the unlabeled data to train an improved classifier using the biased labeled data. 2) To encourage rare class training, whose model is low-recall but high-precision that discards too many pseudo-labeled data, we propose Class-Aware Imputation (CAI) that dynamically decreases (or increases) the pseudo-label assignment threshold for rare (or frequent) classes. 3) Overall, we integrate CAP and CAI into a Class-Aware Doubly Robust (CADR) estimator for training an unbiased SSL model. Under various MNAR settings and ablations, our method not only significantly outperforms existing baselines but also surpasses other label bias removal SSL methods. Please check our code at: https://github.com/JoyHuYY1412/CADR-FixMatch.  ( 2 min )

Ensembles of deep neural networks have demonstrated superior performance, but their heavy computational cost hinders applying them for resource-limited environments. It motivates distilling knowledge from the ensemble teacher into a smaller student network, and there are two important design choices for this ensemble distillation: 1) how to construct the student network, and 2) what data should be shown during training. In this paper, we propose a weight averaging technique where a student with multiple subnetworks is trained to absorb the functional diversity of ensemble teachers, but then those subnetworks are properly averaged for inference, giving a single student network with no additional inference cost. We also propose a perturbation strategy that seeks inputs from which the diversities of teachers can be better transferred to the student. Combining these two, our method significantly improves upon previous methods on various image classification tasks.  ( 2 min )

Physiological measurements involves observing variables that attribute to the normative functioning of human systems and subsystems directly or indirectly. The measurements can be used to detect affective states of a person with aims such as improving human-computer interactions. There are several methods of collecting physiological data, but wearable sensors are a common, non-invasive tool for accurate readings. However, valuable information is hard to extract from the raw physiological data, especially for affective state detection. Machine Learning techniques are used to detect the affective state of a person through labeled physiological data. A clear problem with using labeled data is creating accurate labels. An expert is needed to analyze a form of recording of participants and mark sections with different states such as stress and calm. While expensive, this method delivers a complete dataset with labeled data that can be used in any number of supervised algorithms. An interesting question arises from the expensive labeling: how can we reduce the cost while maintaining high accuracy? Semi-Supervised learning (SSL) is a potential solution to this problem. These algorithms allow for machine learning models to be trained with only a small subset of labeled data (unlike unsupervised which use no labels). They provide a way of avoiding expensive labeling. This paper compares a fully supervised algorithm to a SSL on the public WESAD (Wearable Stress and Affect Detection) Dataset for stress detection. This paper shows that Semi-Supervised algorithms are a viable method for inexpensive affective state detection systems with accurate results.  ( 3 min )

Recently, a family of locally balanced (LB) samplers has demonstrated excellent performance at sampling and learning energy-based models (EBMs) in discrete spaces. However, the theoretical understanding of this success is limited. In this work, we show how LB functions give rise to LB dynamics corresponding to Wasserstein gradient flow in a discrete space. From first principles, previous LB samplers can then be seen as discretizations of the LB dynamics with respect to Hamming distance. Based on this observation, we propose a new algorithm, the Locally Balanced Jump (LBJ), by discretizing the LB dynamics with respect to simulation time. As a result, LBJ has a location-dependent "velocity" that allows it to make proposals with larger distances. Additionally, LBJ decouples each dimension into independent sub-processes, enabling convenient parallel implementation. We demonstrate the advantages of LBJ for sampling and learning in various binary and categorical distributions.  ( 2 min )

Electromyography signals can be used as training data by machine learning models to classify various gestures. We seek to produce a model that can classify six different hand gestures with a limited number of samples that generalizes well to a wider audience while comparing the effect of our feature extraction results on model accuracy to other more conventional methods such as the use of AR parameters on a sliding window across the channels of a signal. We appeal to a set of more elementary methods such as the use of random bounds on a signal, but desire to show the power these methods can carry in an online setting where EMG classification is being conducted, as opposed to more complicated methods such as the use of the Fourier Transform. To augment our limited training data, we used a standard technique, known as jitter, where random noise is added to each observation in a channel wise manner. Once all datasets were produced using the above methods, we performed a grid search with Random Forest and XGBoost to ultimately create a high accuracy model. For human computer interface purposes, high accuracy classification of EMG signals is of particular importance to their functioning and given the difficulty and cost of amassing any sort of biomedical data in a high volume, it is valuable to have techniques that can work with a low amount of high-quality samples with less expensive feature extraction methods that can reliably be carried out in an online application.  ( 3 min )

Data privacy and class imbalance are the norm rather than the exception in many machine learning tasks. Recent attempts have been launched to, on one side, address the problem of learning from pervasive private data, and on the other side, learn from long-tailed data. However, both assumptions might hold in practical applications, while an effective method to simultaneously alleviate both issues is yet under development. In this paper, we focus on learning with long-tailed (LT) data distributions under the context of the popular privacy-preserved federated learning (FL) framework. We characterize three scenarios with different local or global long-tailed data distributions in the FL framework, and highlight the corresponding challenges. The preliminary results under different scenarios reveal that substantial future work are of high necessity to better resolve the characterized federated long-tailed learning tasks.  ( 2 min )

Language models have achieved remarkable performance on a wide range of tasks that require natural language understanding. Nevertheless, state-of-the-art models have generally struggled with tasks that require quantitative reasoning, such as solving mathematics, science, and engineering problems at the college level. To help close this gap, we introduce Minerva, a large language model pretrained on general natural language data and further trained on technical content. The model achieves state-of-the-art performance on technical benchmarks without the use of external tools. We also evaluate our model on over two hundred undergraduate-level problems in physics, biology, chemistry, economics, and other sciences that require quantitative reasoning, and find that the model can correctly answer nearly a third of them.  ( 2 min )

There have been several post-hoc explanation approaches developed to explain pre-trained black-box neural networks. However, there is still a gap in research efforts toward designing neural networks that are inherently explainable. In this paper, we utilize a recently proposed instance-wise post-hoc causal explanation method to make an existing transformer architecture inherently explainable. Once trained, our model provides an explanation in the form of top-$k$ regions in the input space of the given instance contributing to its decision. We evaluate our method on binary classification tasks using three image datasets: MNIST, FMNIST, and CIFAR. Our results demonstrate that compared to the causality-based post-hoc explainer model, our inherently explainable model achieves better explainability results while eliminating the need of training a separate explainer model. Our code is available at https://github.com/mvrl/CAT-XPLAIN.  ( 2 min )

Nonsmooth optimization finds wide applications in many engineering fields. In this work, we propose to utilize the {Randomized Coordinate Subgradient Method} (RCS) for solving both nonsmooth convex and nonsmooth nonconvex (nonsmooth weakly convex) optimization problems. At each iteration, RCS randomly selects one block coordinate rather than all the coordinates to update. Motivated by practical applications, we consider the {linearly bounded subgradients assumption} for the objective function, which is much more general than the Lipschitz continuity assumption. Under such a general assumption, we conduct thorough convergence analysis for RCS in both convex and nonconvex cases and establish both expected convergence rate and almost sure asymptotic convergence results. In order to derive these convergence results, we establish a convergence lemma and the relationship between the global metric subregularity properties of a weakly convex function and its Moreau envelope, which are fundamental and of independent interests. Finally, we conduct several experiments to show the possible superiority of RCS over the subgradient method.  ( 2 min )

Physics-informed neural network (PINN) algorithms have shown promising results in solving a wide range of problems involving partial differential equations (PDEs). However, they often fail to converge to desirable solutions when the target function contains high-frequency features, due to a phenomenon known as spectral bias. In the present work, we exploit neural tangent kernels (NTKs) to investigate the training dynamics of PINNs evolving under stochastic gradient descent with momentum (SGDM). This demonstrates SGDM significantly reduces the effect of spectral bias. We have also examined why training a model via the Adam optimizer can accelerate the convergence while reducing the spectral bias. Moreover, our numerical experiments have confirmed that wide-enough networks using SGDM still converge to desirable solutions, even in the presence of high-frequency features. In fact, we show that the width of a network plays a critical role in convergence.  ( 2 min )

In this paper, we design, analyze the convergence properties and address the implementation aspects of AFAFed. This is a novel Asynchronous Fair Adaptive Federated learning framework for stream-oriented IoT application environments, which are featured by time-varying operating conditions, heterogeneous resource-limited devices (i.e., coworkers), non-i.i.d. local training data and unreliable communication links. The key new of AFAFed is the synergic co-design of: (i) two sets of adaptively tuned tolerance thresholds and fairness coefficients at the coworkers and central server, respectively; and, (ii) a distributed adaptive mechanism, which allows each coworker to adaptively tune own communication rate. The convergence properties of AFAFed under (possibly) non-convex loss functions is guaranteed by a set of new analytical bounds, which formally unveil the impact on the resulting AFAFed convergence rate of a number of Federated Learning (FL) parameters, like, first and second moments of the per-coworker number of consecutive model updates, data skewness, communication packet-loss probability, and maximum/minimum values of the (adaptively tuned) mixing coefficient used for model aggregation.  ( 2 min )

We present a modified tuning of the algorithm of Zimmert and Seldin [2020] for adversarial multiarmed bandits with delayed feedback, which in addition to the minimax optimal adversarial regret guarantee shown by Zimmert and Seldin simultaneously achieves a near-optimal regret guarantee in the stochastic setting with fixed delays. Specifically, the adversarial regret guarantee is $\mathcal{O}(\sqrt{TK} + \sqrt{dT\log K})$, where $T$ is the time horizon, $K$ is the number of arms, and $d$ is the fixed delay, whereas the stochastic regret guarantee is $\mathcal{O}\left(\sum_{i \neq i^*}(\frac{1}{\Delta_i} \log(T) + \frac{d}{\Delta_{i}\log K}) + d K^{1/3}\log K\right)$, where $\Delta_i$ are the suboptimality gaps. We also present an extension of the algorithm to the case of arbitrary delays, which is based on an oracle knowledge of the maximal delay $d_{max}$ and achieves $\mathcal{O}(\sqrt{TK} + \sqrt{D\log K} + d_{max}K^{1/3} \log K)$ regret in the adversarial regime, where $D$ is the total delay, and $\mathcal{O}\left(\sum_{i \neq i^*}(\frac{1}{\Delta_i} \log(T) + \frac{\sigma_{max}}{\Delta_{i}\log K}) + d_{max}K^{1/3}\log K\right)$ regret in the stochastic regime, where $\sigma_{max}$ is the maximal number of outstanding observations. Finally, we present a lower bound that matches regret upper bound achieved by the skipping technique of Zimmert and Seldin [2020] in the adversarial setting.  ( 2 min )

Online influence maximization aims to maximize the influence spread of a content in a social network with unknown network model by selecting a few seed nodes. Recent studies followed a non-adaptive setting, where the seed nodes are selected before the start of the diffusion process and network parameters are updated when the diffusion stops. We consider an adaptive version of content-dependent online influence maximization problem where the seed nodes are sequentially activated based on real-time feedback. In this paper, we formulate the problem as an infinite-horizon discounted MDP under a linear diffusion process and present a model-based reinforcement learning solution. Our algorithm maintains a network model estimate and selects seed users adaptively, exploring the social network while improving the optimal policy optimistically. We establish $\widetilde O(\sqrt{T})$ regret bound for our algorithm. Empirical evaluations on synthetic network demonstrate the efficiency of our algorithm.  ( 2 min )

The success of DNNs is driven by the counter-intuitive ability of over-parameterized networks to generalize, even when they perfectly fit the training data. In practice, test error often continues to decrease with increasing over-parameterization, referred to as double descent. This allows practitioners to instantiate large models without having to worry about over-fitting. Despite its benefits, however, prior work has shown that over-parameterization can exacerbate bias against minority subgroups. Several fairness-constrained DNN training methods have been proposed to address this concern. Here, we critically examine MinDiff, a fairness-constrained training procedure implemented within TensorFlow's Responsible AI Toolkit, that aims to achieve Equality of Opportunity. We show that although MinDiff improves fairness for under-parameterized models, it is likely to be ineffective in the over-parameterized regime. This is because an overfit model with zero training loss is trivially group-wise fair on training data, creating an "illusion of fairness," thus turning off the MinDiff optimization (this will apply to any disparity-based measures which care about errors or accuracy. It won't apply to demographic parity). Within specified fairness constraints, under-parameterized MinDiff models can even have lower error compared to their over-parameterized counterparts (despite baseline over-parameterized models having lower error). We further show that MinDiff optimization is very sensitive to choice of batch size in the under-parameterized regime. Thus, fair model training using MinDiff requires time-consuming hyper-parameter searches. Finally, we suggest using previously proposed regularization techniques, viz. L2, early stopping and flooding in conjunction with MinDiff to train fair over-parameterized models.  ( 3 min )

From the nature of dark matter to the rate of expansion of our Universe, observations of distant galaxies distorted through strong gravitational lensing have the potential to answer some of the major open questions in astrophysics. Modeling galaxy-galaxy strong lensing observations presents a number of challenges as the exact configuration of both the background source and foreground lens galaxy is unknown. A timely call, prompted by a number of upcoming surveys anticipating high-resolution lensing images, demands methods that can efficiently model lenses at their full complexity. In this work, we introduce a method that uses continuous neural fields to non-parametrically reconstruct the complex morphology of a source galaxy while simultaneously inferring a distribution over foreground lens galaxy configurations. We demonstrate the efficacy of our method through experiments on simulated data targeting high-resolution lensing images similar to those anticipated in near-future astrophysical surveys.  ( 2 min )

We study the excess capacity of deep networks in the context of supervised classification. That is, given a capacity measure of the underlying hypothesis class -- in our case, empirical Rademacher complexity -- by how much can we (a priori) constrain this class while retaining an empirical error on a par with the unconstrained regime? To assess excess capacity in modern architectures (such as residual networks), we extend and unify prior Rademacher complexity bounds to accommodate function composition and addition, as well as the structure of convolutions. The capacity-driving terms in our bounds are the Lipschitz constants of the layers and a (2,1) group norm distance to the initializations of the convolution weights. Experiments on benchmark datasets of varying task difficulty indicate that (1) there is a substantial amount of excess capacity per task, and (2) capacity can be kept at a surprisingly similar level across tasks. Overall, this suggests a notion of compressibility with respect to weight norms, orthogonal to classic compression via weight pruning.  ( 2 min )

In optimization for Machine learning (ML), it is typical that curvature-matrix (CM) estimates rely on an exponential average (EA) of local estimates (giving EA-CM algorithms). This approach has little principled justification, but is very often used in practice. In this paper, we draw a connection between EA-CM algorithms and what we call a "Wake of Quadratic regularized models". The outlined connection allows us to understand what EA-CM algorithms are doing from an optimization perspective. Generalizing from the established connection, we propose a new family of algorithms, "KL-Divergence Wake-Regularized Models" (KLD-WRM). We give three different practical instantiations of KLD-WRM, and show numerically that these outperform K-FAC on MNIST.  ( 2 min )

Identification of nonlinear dynamic systems remains a significant challenge across engineering. This work suggests an approach based on Bayesian filtering to extract and identify the contribution of an unknown nonlinear term in the system which can be seen as an alternative viewpoint on restoring force surface type approaches. To achieve this identification, the contribution which is the nonlinear restoring force is modelled, initially, as a Gaussian process in time. That Gaussian process is converted into a state-space model and combined with the linear dynamic component of the system. Then, by inference of the filtering and smoothing distributions, the internal states of the system and the nonlinear restoring force can be extracted. In possession of these states a nonlinear model can be constructed. The approach is demonstrated to be effective in both a simulated case study and on an experimental benchmark dataset.  ( 2 min )

Understanding generalization in modern machine learning settings has been one of the major challenges in statistical learning theory. In this context, recent years have witnessed the development of various generalization bounds suggesting different complexity notions such as the mutual information between the data sample and the algorithm output, compressibility of the hypothesis space, and the fractal dimension of the hypothesis space. While these bounds have illuminated the problem at hand from different angles, their suggested complexity notions might appear seemingly unrelated, thereby restricting their high-level impact. In this study, we prove novel generalization bounds through the lens of rate-distortion theory, and explicitly relate the concepts of mutual information, compressibility, and fractal dimensions in a single mathematical framework. Our approach consists of (i) defining a generalized notion of compressibility by using source coding concepts, and (ii) showing that the `compression error rate' can be linked to the generalization error both in expectation and with high probability. We show that in the `lossless compression' setting, we recover and improve existing mutual information-based bounds, whereas a `lossy compression' scheme allows us to link generalization to the rate-distortion dimension -- a particular notion of fractal dimension. Our results bring a more unified perspective on generalization and open up several future research directions.  ( 3 min )

We present a modified tuning of the algorithm of Zimmert and Seldin [2020] for adversarial multiarmed bandits with delayed feedback, which in addition to the minimax optimal adversarial regret guarantee shown by Zimmert and Seldin simultaneously achieves a near-optimal regret guarantee in the stochastic setting with fixed delays. Specifically, the adversarial regret guarantee is $\mathcal{O}(\sqrt{TK} + \sqrt{dT\log K})$, where $T$ is the time horizon, $K$ is the number of arms, and $d$ is the fixed delay, whereas the stochastic regret guarantee is $\mathcal{O}\left(\sum_{i \neq i^*}(\frac{1}{\Delta_i} \log(T) + \frac{d}{\Delta_{i}\log K}) + d K^{1/3}\log K\right)$, where $\Delta_i$ are the suboptimality gaps. We also present an extension of the algorithm to the case of arbitrary delays, which is based on an oracle knowledge of the maximal delay $d_{max}$ and achieves $\mathcal{O}(\sqrt{TK} + \sqrt{D\log K} + d_{max}K^{1/3} \log K)$ regret in the adversarial regime, where $D$ is the total delay, and $\mathcal{O}\left(\sum_{i \neq i^*}(\frac{1}{\Delta_i} \log(T) + \frac{\sigma_{max}}{\Delta_{i}\log K}) + d_{max}K^{1/3}\log K\right)$ regret in the stochastic regime, where $\sigma_{max}$ is the maximal number of outstanding observations. Finally, we present a lower bound that matches regret upper bound achieved by the skipping technique of Zimmert and Seldin [2020] in the adversarial setting.  ( 2 min )

Most of the existing methods for estimating the local intrinsic dimension of a data distribution do not scale well to high-dimensional data. Many of them rely on a non-parametric nearest neighbors approach which suffers from the curse of dimensionality. We attempt to address that challenge by proposing a novel approach to the problem: Local Intrinsic Dimension estimation using approximate Likelihood (LIDL). Our method relies on an arbitrary density estimation method as its subroutine and hence tries to sidestep the dimensionality challenge by making use of the recent progress in parametric neural methods for likelihood estimation. We carefully investigate the empirical properties of the proposed method, compare them with our theoretical predictions, and show that LIDL yields competitive results on the standard benchmarks for this problem and that it scales to thousands of dimensions. What is more, we anticipate this approach to improve further with the continuing advances in the density estimation literature.  ( 2 min )

Randomly initialized wide neural networks transition to linear functions of weights as the width grows, in a ball of radius $O(1)$ around initialization. A necessary condition for this result is that all layers of the network are wide enough, i.e., all widths tend to infinity. However, the transition to linearity breaks down when this infinite width assumption is violated. In this work we show that linear networks with a bottleneck layer learn bilinear functions of the weights, in a ball of radius $O(1)$ around initialization. In general, for $B-1$ bottleneck layers, the network is a degree $B$ multilinear function of weights. Importantly, the degree only depends on the number of bottlenecks and not the total depth of the network.  ( 2 min )

Forward modeling approaches in cosmology have made it possible to reconstruct the initial conditions at the beginning of the Universe from the observed survey data. However the high dimensionality of the parameter space still poses a challenge to explore the full posterior, with traditional algorithms such as Hamiltonian Monte Carlo (HMC) being computationally inefficient due to generating correlated samples and the performance of variational inference being highly dependent on the choice of divergence (loss) function. Here we develop a hybrid scheme, called variational self-boosted sampling (VBS) to mitigate the drawbacks of both these algorithms by learning a variational approximation for the proposal distribution of Monte Carlo sampling and combine it with HMC. The variational distribution is parameterized as a normalizing flow and learnt with samples generated on the fly, while proposals drawn from it reduce auto-correlation length in MCMC chains. Our normalizing flow uses Fourier space convolutions and element-wise operations to scale to high dimensions. We show that after a short initial warm-up and training phase, VBS generates better quality of samples than simple VI approaches and reduces the correlation length in the sampling phase by a factor of 10-50 over using only HMC to explore the posterior of initial conditions in 64$^3$ and 128$^3$ dimensional problems, with larger gains for high signal-to-noise data observations.  ( 3 min )

Significant theoretical work has established that in specific regimes, neural networks trained by gradient descent behave like kernel methods. However, in practice, it is known that neural networks strongly outperform their associated kernels. In this work, we explain this gap by demonstrating that there is a large class of functions which cannot be efficiently learned by kernel methods but can be easily learned with gradient descent on a two layer neural network outside the kernel regime by learning representations that are relevant to the target task. We also demonstrate that these representations allow for efficient transfer learning, which is impossible in the kernel regime. Specifically, we consider the problem of learning polynomials which depend on only a few relevant directions, i.e. of the form $f^\star(x) = g(Ux)$ where $U: \R^d \to \R^r$ with $d \gg r$. When the degree of $f^\star$ is $p$, it is known that $n \asymp d^p$ samples are necessary to learn $f^\star$ in the kernel regime. Our primary result is that gradient descent learns a representation of the data which depends only on the directions relevant to $f^\star$. This results in an improved sample complexity of $n\asymp d^2 r + dr^p$. Furthermore, in a transfer learning setup where the data distributions in the source and target domain share the same representation $U$ but have different polynomial heads we show that a popular heuristic for transfer learning has a target sample complexity independent of $d$.  ( 3 min )

Recent work on deep learning for tabular data demonstrates the strong performance of deep tabular models, often bridging the gap between gradient boosted decision trees and neural networks. Accuracy aside, a major advantage of neural models is that they learn reusable features and are easily fine-tuned in new domains. This property is often exploited in computer vision and natural language applications, where transfer learning is indispensable when task-specific training data is scarce. In this work, we demonstrate that upstream data gives tabular neural networks a decisive advantage over widely used GBDT models. We propose a realistic medical diagnosis benchmark for tabular transfer learning, and we present a how-to guide for using upstream data to boost performance with a variety of tabular neural network architectures. Finally, we propose a pseudo-feature method for cases where the upstream and downstream feature sets differ, a tabular-specific problem widespread in real-world applications. Our code is available at https://github.com/LevinRoman/tabular-transfer-learning .  ( 2 min )

Reconstructing 3D objects from 2D images is both challenging for our brains and machine learning algorithms. To support this spatial reasoning task, contextual information about the overall shape of an object is critical. However, such information is not captured by established loss terms (e.g. Dice loss). We propose to complement geometrical shape information by including multi-scale topological features, such as connected components, cycles, and voids, in the reconstruction loss. Our method uses cubical complexes to calculate topological features of 3D volume data and employs an optimal transport distance to guide the reconstruction process. This topology-aware loss is fully differentiable, computationally efficient, and can be added to any neural network. We demonstrate the utility of our loss by incorporating it into SHAPR, a model for predicting the 3D cell shape of individual cells based on 2D microscopy images. Using a hybrid loss that leverages both geometrical and topological information of single objects to assess their shape, we find that topological information substantially improves the quality of reconstructions, thus highlighting its ability to extract more relevant features from image datasets.  ( 3 min )

Pruning neural networks reduces inference time and memory costs. On standard hardware, these benefits will be especially prominent if coarse-grained structures, like feature maps, are pruned. We devise two novel saliency-based methods for second-order structured pruning (SOSP) which include correlations among all structures and layers. Our main method SOSP-H employs an innovative second-order approximation, which enables saliency evaluations by fast Hessian-vector products. SOSP-H thereby scales like a first-order method despite taking into account the full Hessian. We validate SOSP-H by comparing it to our second method SOSP-I that uses a well-established Hessian approximation, and to numerous state-of-the-art methods. While SOSP-H performs on par or better in terms of accuracy, it has clear advantages in terms of scalability and efficiency. This allowed us to scale SOSP-H to large-scale vision tasks, even though it captures correlations across all layers of the network. To underscore the global nature of our pruning methods, we evaluate their performance not only by removing structures from a pretrained network, but also by detecting architectural bottlenecks. We show that our algorithms allow to systematically reveal architectural bottlenecks, which we then remove to further increase the accuracy of the networks.  ( 3 min )

Automated decision support systems that are able to infer second opinions from experts can potentially facilitate a more efficient allocation of resources; they can help decide when and from whom to seek a second opinion. In this paper, we look at the design of this type of support systems from the perspective of counterfactual inference. We focus on a multiclass classification setting and first show that, if experts make predictions on their own, the underlying causal mechanism generating their predictions needs to satisfy a desirable set invariant property. Further, we show that, for any causal mechanism satisfying this property, there exists an equivalent mechanism where the predictions by each expert are generated by independent sub-mechanisms governed by a common noise. This motivates the design of a set invariant Gumbel-Max structural causal model where the structure of the noise governing the sub-mechanisms underpinning the model depends on an intuitive notion of similarity between experts which can be estimated from data. Experiments on both synthetic and real data show that our model can be used to infer second opinions more accurately than its non-causal counterpart.  ( 2 min )

We study two problems related to recovering causal graphs from interventional data: (i) $\textit{verification}$, where the task is to check if a purported causal graph is correct, and (ii) $\textit{search}$, where the task is to recover the correct causal graph. For both, we wish to minimize the number of interventions performed. For the first problem, we give a characterization of a minimal sized set of atomic interventions that is necessary and sufficient to check the correctness of a claimed causal graph. Our characterization uses the notion of $\textit{covered edges}$, which enables us to obtain simple proofs and also easily reason about earlier results. We also generalize our results to the settings of bounded size interventions and node-dependent interventional costs. For all the above settings, we provide the first known provable algorithms for efficiently computing (near)-optimal verifying sets on general graphs. For the second problem, we give a simple adaptive algorithm based on graph separators that produces an atomic intervention set which fully orients any essential graph while using $\mathcal{O}(\log n)$ times the optimal number of interventions needed to $\textit{verify}$ (verifying size) the underlying DAG on $n$ vertices. This approximation is tight as $\textit{any}$ search algorithm on an essential line graph has worst case approximation ratio of $\Omega(\log n)$ with respect to the verifying size. With bounded size interventions, each of size $\leq k$, our algorithm gives an $\mathcal{O}(\log n \cdot \log \log k)$ factor approximation. Our result is the first known algorithm that gives a non-trivial approximation guarantee to the verifying size on general unweighted graphs and with bounded size interventions.  ( 3 min )

There has been a massive increase in research interest towards applying data driven methods to problems in mechanics. While traditional machine learning (ML) methods have enabled many breakthroughs, they rely on the assumption that the training (observed) data and testing (unseen) data are independent and identically distributed (i.i.d). Thus, traditional ML approaches often break down when applied to real world mechanics problems with unknown test environments and data distribution shifts. In contrast, out-of-distribution (OOD) generalization assumes that the test data may shift (i.e., violate the i.i.d. assumption). To date, multiple methods have been proposed to improve the OOD generalization of ML methods. However, because of the lack of benchmark datasets for OOD regression problems, the efficiency of these OOD methods on regression problems, which dominate the mechanics field, remains unknown. To address this, we investigate the performance of OOD generalization methods for regression problems in mechanics. Specifically, we identify three OOD problems: covariate shift, mechanism shift, and sampling bias. For each problem, we create two benchmark examples that extend the Mechanical MNIST dataset collection, and we investigate the performance of popular OOD generalization methods on these mechanics-specific regression problems. Our numerical experiments show that in most cases, while the OOD generalization algorithms perform better compared to traditional ML methods on these OOD problems, there is a compelling need to develop more robust OOD generalization methods that are effective across multiple OOD scenarios. Overall, we expect that this study, as well as the associated open access benchmark datasets, will enable further development of OOD generalization methods for mechanics specific regression problems.  ( 3 min )

The expressive and computationally inexpensive bipartite Graph Neural Networks (GNN) have been shown to be an important component of deep learning based Mixed-Integer Linear Program (MILP) solvers. Recent works have demonstrated the effectiveness of such GNNs in replacing the branching (variable selection) heuristic in branch-and-bound (B&B) solvers. These GNNs are trained, offline and on a collection of MILPs, to imitate a very good but computationally expensive branching heuristic, strong branching. Given that B&B results in a tree of sub-MILPs, we ask (a) whether there are strong dependencies exhibited by the target heuristic among the neighboring nodes of the B&B tree, and (b) if so, whether we can incorporate them in our training procedure. Specifically, we find that with the strong branching heuristic, a child node's best choice was often the parent's second-best choice. We call this the "lookback" phenomenon. Surprisingly, the typical branching GNN of Gasse et al. (2019) often misses this simple "answer". To imitate the target behavior more closely by incorporating the lookback phenomenon in GNNs, we propose two methods: (a) target smoothing for the standard cross-entropy loss function, and (b) adding a Parent-as-Target (PAT) Lookback regularizer term. Finally, we propose a model selection framework to incorporate harder-to-formulate objectives such as solving time in the final models. Through extensive experimentation on standard benchmark instances, we show that our proposal results in up to 22% decrease in the size of the B&B tree and up to 15% improvement in the solving times.  ( 3 min )

Electromyography signals can be used as training data by machine learning models to classify various gestures. We seek to produce a model that can classify six different hand gestures with a limited number of samples that generalizes well to a wider audience while comparing the effect of our feature extraction results on model accuracy to other more conventional methods such as the use of AR parameters on a sliding window across the channels of a signal. We appeal to a set of more elementary methods such as the use of random bounds on a signal, but desire to show the power these methods can carry in an online setting where EMG classification is being conducted, as opposed to more complicated methods such as the use of the Fourier Transform. To augment our limited training data, we used a standard technique, known as jitter, where random noise is added to each observation in a channel wise manner. Once all datasets were produced using the above methods, we performed a grid search with Random Forest and XGBoost to ultimately create a high accuracy model. For human computer interface purposes, high accuracy classification of EMG signals is of particular importance to their functioning and given the difficulty and cost of amassing any sort of biomedical data in a high volume, it is valuable to have techniques that can work with a low amount of high-quality samples with less expensive feature extraction methods that can reliably be carried out in an online application.  ( 3 min )

We consider the task of meta-analysis in high-dimensional settings in which the data sources are similar but non-identical. To borrow strength across such heterogeneous datasets, we introduce a global parameter that emphasizes interpretability and statistical efficiency in the presence of heterogeneity. We also propose a one-shot estimator of the global parameter that preserves the anonymity of the data sources and converges at a rate that depends on the size of the combined dataset. For high-dimensional linear model settings, we demonstrate the superiority of our identification restrictions in adapting to a previously seen data distribution as well as predicting for a new/unseen data distribution. Finally, we demonstrate the benefits of our approach on a large-scale drug treatment dataset involving several different cancer cell-lines.  ( 2 min )

Finding equilibria points in continuous minimax games has become a key problem within machine learning, in part due to its connection to the training of generative adversarial networks. Because of existence and robustness issues, recent developments have shifted from pure equilibria to focusing on mixed equilibria points. In this note we consider a method proposed by Domingo-Enrich et al. for finding mixed equilibria in two-layer zero-sum games. The method is based on entropic regularisation and the two competing strategies are represented by two sets of interacting particles. We show that the sequence of empirical measures of the particle system satisfies a large deviation principle as the number of particles grows to infinity, and how this implies convergence of the empirical measure and the associated Nikaid\^o-Isoda error, complementing existing law of large numbers results.  ( 2 min )

We propose a novel anomaly detection method for echocardiogram videos. The introduced method takes advantage of the periodic nature of the heart cycle to learn different variants of a variational latent trajectory model (TVAE). The models are trained on the healthy samples of an in-house dataset of infant echocardiogram videos consisting of multiple chamber views to learn a normative prior of the healthy population. During inference, maximum a posteriori (MAP) based anomaly detection is performed to detect out-of-distribution samples in our dataset. The proposed method reliably identifies severe congenital heart defects, such as Ebstein's Anomaly or Shonecomplex. Moreover, it achieves superior performance over MAP-based anomaly detection with standard variational autoencoders on the task of detecting pulmonary hypertension and right ventricular dilation. Finally, we demonstrate that the proposed method provides interpretable explanations of its output through heatmaps which highlight the regions corresponding to anomalous heart structures.  ( 2 min )

This work discusses how to derive upper bounds for the expected generalisation error of supervised learning algorithms by means of the chaining technique. By developing a general theoretical framework, we establish a duality between generalisation bounds based on the regularity of the loss function, and their chained counterparts, which can be obtained by lifting the regularity assumption from the loss onto its gradient. This allows us to re-derive the chaining mutual information bound from the literature, and to obtain novel chained information-theoretic generalisation bounds, based on the Wasserstein distance and other probability metrics. We show on some toy examples that the chained generalisation bound can be significantly tighter than its standard counterpart, particularly when the distribution of the hypotheses selected by the algorithm is very concentrated. Keywords: Generalisation bounds; Chaining; Information-theoretic bounds; Mutual information; Wasserstein distance; PAC-Bayes.  ( 2 min )

We assess the demand effects of discounts on train tickets issued by the Swiss Federal Railways, the so-called `supersaver tickets', based on machine learning, a subfield of artificial intelligence. Considering a survey-based sample of buyers of supersaver tickets, we investigate which customer- or trip-related characteristics (including the discount rate) predict buying behavior, namely: booking a trip otherwise not realized by train, buying a first- rather than second-class ticket, or rescheduling a trip (e.g.\ away from rush hours) when being offered a supersaver ticket. Predictive machine learning suggests that customer's age, demand-related information for a specific connection (like departure time and utilization), and the discount level permit forecasting buying behavior to a certain extent. Furthermore, we use causal machine learning to assess the impact of the discount rate on rescheduling a trip, which seems relevant in the light of capacity constraints at rush hours. Assuming that (i) the discount rate is quasi-random conditional on our rich set of characteristics and (ii) the buying decision increases weakly monotonically in the discount rate, we identify the discount rate's effect among `always buyers', who would have traveled even without a discount, based on our survey that asks about customer behavior in the absence of discounts. We find that on average, increasing the discount rate by one percentage point increases the share of rescheduled trips by 0.16 percentage points among always buyers. Investigating effect heterogeneity across observables suggests that the effects are higher for leisure travelers and during peak hours when controlling several other characteristics.  ( 3 min )

Online influence maximization aims to maximize the influence spread of a content in a social network with unknown network model by selecting a few seed nodes. Recent studies followed a non-adaptive setting, where the seed nodes are selected before the start of the diffusion process and network parameters are updated when the diffusion stops. We consider an adaptive version of content-dependent online influence maximization problem where the seed nodes are sequentially activated based on real-time feedback. In this paper, we formulate the problem as an infinite-horizon discounted MDP under a linear diffusion process and present a model-based reinforcement learning solution. Our algorithm maintains a network model estimate and selects seed users adaptively, exploring the social network while improving the optimal policy optimistically. We establish $\widetilde O(\sqrt{T})$ regret bound for our algorithm. Empirical evaluations on synthetic network demonstrate the efficiency of our algorithm.  ( 2 min )

Distributional shift, or the mismatch between training and deployment data, is a significant obstacle to the usage of machine learning in high-stakes industrial applications, such as autonomous driving and medicine. This creates a need to be able to assess how robustly ML models generalize as well as the quality of their uncertainty estimates. Standard ML baseline datasets do not allow these properties to be assessed, as the training, validation and test data are often identically distributed. Recently, a range of dedicated benchmarks have appeared, featuring both distributionally matched and shifted data. Among these benchmarks, the Shifts dataset stands out in terms of the diversity of tasks as well as the data modalities it features. While most of the benchmarks are heavily dominated by 2D image classification tasks, Shifts contains tabular weather forecasting, machine translation, and vehicle motion prediction tasks. This enables the robustness properties of models to be assessed on a diverse set of industrial-scale tasks and either universal or directly applicable task-specific conclusions to be reached. In this paper, we extend the Shifts Dataset with two datasets sourced from industrial, high-risk applications of high societal importance. Specifically, we consider the tasks of segmentation of white matter Multiple Sclerosis lesions in 3D magnetic resonance brain images and the estimation of power consumption in marine cargo vessels. Both tasks feature ubiquitous distributional shifts and a strict safety requirement due to the high cost of errors. These new datasets will allow researchers to further explore robust generalization and uncertainty estimation in new situations. In this work, we provide a description of the dataset and baseline results for both tasks.  ( 3 min )

Model selection in contextual bandits is an important complementary problem to regret minimization with respect to a fixed model class. We consider the simplest non-trivial instance of model-selection: distinguishing a simple multi-armed bandit problem from a linear contextual bandit problem. Even in this instance, current state-of-the-art methods explore in a suboptimal manner and require strong "feature-diversity" conditions. In this paper, we introduce new algorithms that a) explore in a data-adaptive manner, and b) provide model selection guarantees of the form $\mathcal{O}(d^{\alpha} T^{1- \alpha})$ with no feature diversity conditions whatsoever, where $d$ denotes the dimension of the linear model and $T$ denotes the total number of rounds. The first algorithm enjoys a "best-of-both-worlds" property, recovering two prior results that hold under distinct distributional assumptions, simultaneously. The second removes distributional assumptions altogether, expanding the scope for tractable model selection. Our approach extends to model selection among nested linear contextual bandits under some additional assumptions.  ( 2 min )

Procrastination, the irrational delay of tasks, is a common occurrence in online learning. Potential negative consequences include higher risk of drop-outs, increased stress, and reduced mood. Due to the rise of learning management systems and learning analytics, indicators of such behavior can be detected, enabling predictions of future procrastination and other dilatory behavior. However, research focusing on such predictions is scarce. Moreover, studies involving different types of predictors and comparisons between the predictive performance of various methods are virtually non-existent. In this study, we aim to fill these research gaps by analyzing the performance of multiple machine learning algorithms when predicting the delayed or timely submission of online assignments in a higher education setting with two categories of predictors: subjective, questionnaire-based variables and objective, log-data based indicators extracted from a learning management system. The results show that models with objective predictors consistently outperform models with subjective predictors, and a combination of both variable types perform slightly better. For each of these three options, a different approach prevailed (Gradient Boosting Machines for the subjective, Bayesian multilevel models for the objective, and Random Forest for the combined predictors). We conclude that careful attention should be paid to the selection of predictors and algorithms before implementing such models in learning management systems.  ( 3 min )

The loss surface of an overparameterized neural network (NN) possesses many global minima of zero training error. We explain how common variants of the standard NN training procedure change the minimizer obtained. First, we make explicit how the size of the initialization of a strongly overparameterized NN affects the minimizer and can deteriorate its final test performance. We propose a strategy to limit this effect. Then, we demonstrate that for adaptive optimization such as AdaGrad, the obtained minimizer generally differs from the gradient descent (GD) minimizer. This adaptive minimizer is changed further by stochastic mini-batch training, even though in the non-adaptive case, GD and stochastic GD result in essentially the same minimizer. Lastly, we explain that these effects remain relevant for less overparameterized NNs. While overparameterization has its benefits, our work highlights that it induces sources of error absent from underparameterized models.  ( 2 min )

In this work we study the problem of Subspace Tracking with missing data (ST-miss) and outliers (Robust ST-miss). We propose a novel algorithm, and provide a guarantee for both these problems. Unlike past work on this topic, the current work does not impose the piecewise constant subspace change assumption. Additionally, the proposed algorithm is much simpler (uses fewer parameters) than our previous work. Secondly, we extend our approach and its analysis to provably solving these problems when the data is federated and when the over-air data communication modality is used for information exchange between the $K$ peer nodes and the center. We validate our theoretical claims with extensive numerical experiments.  ( 2 min )

Wasserstein GANs with Gradient Penalty (WGAN-GP) are a very popular method for training generative models to produce high quality synthetic data. While WGAN-GP were initially developed to calculate the Wasserstein 1 distance between generated and real data, recent works (e.g. [23]) have provided empirical evidence that this does not occur, and have argued that WGAN-GP perform well not in spite of this issue, but because of it. In this paper we show for the first time that WGAN-GP compute the minimum of a different optimal transport problem, the so-called congested transport [7]. Congested transport determines the cost of moving one distribution to another under a transport model that penalizes congestion. For WGAN-GP, we find that the congestion penalty has a spatially varying component determined by the sampling strategy used in [12] which acts like a local speed limit, making congestion cost less in some regions than others. This aspect of the congested transport problem is new, in that the congestion penalty turns out to be unbounded and depends on the distributions to be transported, and so we provide the necessary mathematical proofs for this setting. One facet of our discovery is a formula connecting the gradient of solutions to the optimization problem in WGAN-GP to the time averaged momentum of the optimal mass flow. This is in contrast to the gradient of Kantorovich potentials for the Wasserstein 1 distance, which is just the normalized direction of flow. Based on this and other considerations, we speculate on how our results explain the observed performance of WGAN-GP. Beyond applications to GANs, our theorems also point to the possibility of approximately solving large scale congested transport problems using neural network techniques.  ( 3 min )

K-FAC is a successful tractable implementation of Natural Gradient for Deep Learning, which nevertheless suffers from the requirement to compute the inverse of the Kronecker factors (through an eigen-decomposition). This can be very time-consuming (or even prohibitive) when these factors are large. In this paper, we theoretically show that, owing to the exponential-average construction paradigm of the Kronecker factors that is typically used, their eigen-spectrum must decay. We show numerically that in practice this decay is very rapid, leading to the idea that we could save substantial computation by only focusing on the first few eigen-modes when inverting the Kronecker-factors. Randomized Numerical Linear Algebra provides us with the necessary tools to do so. Numerical results show we obtain $\approx2.5\times$ reduction in per-epoch time and $\approx3.3\times$ reduction in time to target accuracy. We compare our proposed K-FAC sped-up versions with a more computationally efficient NG implementation, SENG, and observe we perform on par with it.  ( 2 min )

We study the problem of model selection in bandit scenarios in the presence of nested policy classes, with the goal of obtaining simultaneous adversarial and stochastic ("best of both worlds") high-probability regret guarantees. Our approach requires that each base learner comes with a candidate regret bound that may or may not hold, while our meta algorithm plays each base learner according to a schedule that keeps the base learner's candidate regret bounds balanced until they are detected to violate their guarantees. We develop careful mis-specification tests specifically designed to blend the above model selection criterion with the ability to leverage the (potentially benign) nature of the environment. We recover the model selection guarantees of the CORRAL algorithm for adversarial environments, but with the additional benefit of achieving high probability regret bounds, specifically in the case of nested adversarial linear bandits. More importantly, our model selection results also hold simultaneously in stochastic environments under gap assumptions. These are the first theoretical results that achieve best of both world (stochastic and adversarial) guarantees while performing model selection in (linear) bandit scenarios.  ( 2 min )

Learning nonparametric systems of Ordinary Differential Equations (ODEs) $\dot x = f(t,x)$ from noisy and sparse data is an emerging machine learning topic. We use the well-developed theory of Reproducing Kernel Hilbert Spaces (RKHS) to define candidates for $f$ for which the solution of the ODE exists and is unique. Learning $f$ consists of solving a constrained optimization problem in an RKHS. We propose a penalty method that iteratively uses the Representer theorem and Euler approximations to provide a numerical solution. We prove a generalization bound for the $L^2$ distance between $x$ and its estimator. Experiments are provided for the FitzHugh Nagumo oscillator and for the prediction of the Amyloid level in the cortex of aging subjects. In both cases, we show competitive results when compared with the state of the art.  ( 2 min )

One of the major concerns of targeting interventions on individuals in social welfare programs is discrimination: individualized treatments may induce disparities across sensitive attributes such as age, gender, or race. This paper addresses the question of the design of fair and efficient treatment allocation rules. We adopt the non-maleficence perspective of first do no harm: we select the fairest allocation within the Pareto frontier. We cast the optimization into a mixed-integer linear program formulation, which can be solved using off-the-shelf algorithms. We derive regret bounds on the unfairness of the estimated policy function and small sample guarantees on the Pareto frontier under general notions of fairness. Finally, we illustrate our method using an application from education economics.  ( 2 min )

I was reading something this afternoon and ran across φ(φ(m)) and thought that was unusual. I often run across φ(m), the number of positive integers less than m and relative prime to m, but don’t often see Euler’s phi function iterated. Application of φ∘φ This section will give an example of a theorem where φ(φ(m)) […] Phi Phi first appeared on John D. Cook.  ( 5 min )

I am writing a research paper, and in it I use a proprietary ML model I made. I want to show the model's results and I can explain how it works, but I don't want to explicitly provide the model/its code. Is that commonplace in research papers or must I include specifics to show validity? submitted by /u/Typical-Ad-7443 [link] [comments]  ( 87 min )

Hello. I have built a dataset that contains results of experiments I have been doing over some physical materials. Each row contains summary data for each piece, like width, height, weight, etc. Then I have several columns which values are arrays. Each one of these columns contain a list of tuples, for example (162636363, 1373.8377). The first number is a timestamp, the second one the magnitude of a force applied to the material (or, for instance, the position where the force was applied, contact duration, etc.). We have hundreds or even thousands of tuples on each column. So, all columns represent measurements of the experiments done to a particular material. We are recording when the material is damaged, since we want to predict its lifetime when the material is exposed to repetitive forces. I'm wondering what to do with those array values. One option is to sort the tuples lists by timestamp and then treat the readings as a vector of a predefined dimension. But I have never fed this kind of data to a boosted tree model/framework like XGBoost. The only experience I had feeding long vectors to a model was when doing some NLP, in that case the vectors were representations of words. Do you think a vector made of all my experiments over a material can be treated as an embedding in a way? If so, how is the recommended way to proceed with this data in the modeling stage? Time series perhaps? I'd appreciate your ideas and comments. Thanks!! submitted by /u/iblysa [link] [comments]  ( 87 min )

So I've read up on ViT, and while it's an impressive architecture, I seem to notice that they are using a [class] token to get the actual class from an input image (see image below). ​ Architecture of ViT While I know that it's standard to use an extra token in this fashion, since the encoder spits out one embedding for every input token (or patch in this case), I was wondering why don't we simply concatenate all the embeddings before feeding them into the MLP head (of an appropriate size)? ​ It seems to me like we are discarding a lot of information here, that could be helpful in the classification task. It's true, in theory, that the attention should take care of that, but do you know of any papers where this concatenation strategy has been tried? Does it even make sense? ​ Cheers! submitted by /u/MurlocXYZ [link] [comments]  ( 87 min )

Hi, very long time lurker here. I'm planning to propose an end to end architecture for my daughter's sake. Data is biomedical and any CNN is well capable of classfying if over %95 Acc (easy data u know!). However, I need to come up with an acronym to fit my daughter's name. Her name is DURU and here is what I come up with: D- Deep (Deep like you know, deep learning) U-Unified (I may use multiple models to form up an ensemble or feature concat, which will make it unified) R- Residual (I may use residual connections between Cnn blocks. Though not flashy right now.) R- Recommender (Could use recommender keyword, since I'm putting down sort of a Computer Aided Diagnosis Framework thingy) R- Another R thing is welcome. U - I need another U and I'm totally out of words. Three letters is all I came up with. Couldn't find a word for the 4th letter that makes sense. U-net? I'm not segmentating anything. But if it was a segmentation dataset I may have come up with DUR-UNet which would make sense. I need a final keyword starting with U which is applicable with CNNs. It could be minor trick to cope with overfitting, a loss function, an activation function, etc. It could also be a filler term like Unified. Hope we could come up with a solution. submitted by /u/cltexe [link] [comments]  ( 87 min )

I am very excited to share our latest research: Causal inference in the scenario of an energy-efficient building design to answer "what-if" questions during the design process. Abs: "What-if" questions are intuitively generated and commonly asked during the design process. Engineers and architects need to inherently conduct design decisions, progressing from one phase to another. They either use empirical domain experience, simulations, or data-driven methods to provide consequential feedback. We take an example from an interdisciplinary domain of energy-efficient building design to argue that the current methods for decision support have four limitations: 1. Less carefully inspected parametric independence raises the risks of biased results and spurious relationships. 2. The integration …  ( 88 min )

I am using dlib.get_frontal_face_detector() And fir large images (several mb) it takes a lot of time to detect a face. What are the ways to increase speed of face detection, without sacrificing accuracy? I cannot use gpu/cuda sadly... submitted by /u/glorsh66 [link] [comments]  ( 86 min )

Generally actor critic algorithms have 1 Neural net giving 1 of each via a linear layer - to give a policy and to give the value. But humans change decisions and how they think based on their mood. I wanted to incorporate this into a standard actor critic like A2C/A3C. I wanted to add another actor in this architecture that represented a certain mood, where it's objective was not to maximize the reward but something else that I have in mind. I don't see any such literature in the field and I don't know how to add more actors. Is it not possible to have multiple actors with one critic ? Has this been passed on by the community for a lack of potential ? submitted by /u/darthsocker [link] [comments]  ( 87 min )

Upgini is a simple feature search & enrichment library in Python. With Upgini, you spend less time for external data search and feature engineering, which will be done for you automatically. Just use your labeled dataset to initiate search through thousands of features and data sources, including public datasets and scraped data shared by Data science community. Only the relevant features that improve prediction power of your ML model are returned. Motivation: for most supervised ML models external data & features boost accuracy significantly better than any hyperparameters tuning. But lack of automated and time-efficient search tools for external data blocks massive adoption of external features in ML pipelines.We want radically simplify features search and delivery for ML pipelines to make external data a standard approach. Like a hyperparameter tuning for machine learning nowadays. Mission: Democratize access to data sources for data science community. 📊 Data coverage and statistics Total: 239 countries and up to 41 years of history https://preview.redd.it/oj87fnkw9s891.png?width=1220&format=png&auto=webp&s=4195a607addca12d400bc4b0b62307ac4db87b67 More info about the library To install Upgini from PyPI run pip install -U upgini Full release notes: https://github.com/upgini/upgini Try the online demo at Colab. submitted by /u/AnnualLimp1418 [link] [comments]  ( 87 min )

The new release of a fast and flexible library for image augmentation includes: New augmentations: UnsharpMask sharpens the input image using Unsharp Masking processing and overlays the result with the original image. PixelDropout randomly replaces pixels with the passed value. https://preview.redd.it/ic1nm7mw3s891.png?width=942&format=png&auto=webp&s=c95e319f26a19bad42d33fd84e0ef27703db9095 RingingOvershoot creates ringing or overshoot artifacts by convolving the image with a 2D sinc filter. AdvancedBlur blurs the input image using a Generalized Normal filter with randomly selected parameters. It also adds multiplicative noise to generated kernel before convolution. https://preview.redd.it/wb1v6vyw3s891.png?width=941&format=png&auto=webp&s=2e57ae1b583b7aab7c30125058a25ee296afd2bd Improvements and bug fixes Fixed all np.random use cases to prevent identical values when using multiprocessing. Also, we fixed corner cases and made improvements for many augmentations. Release notes Full release notes are available at https://github.com/albumentations-team/albumentations/releases/tag/1.2.0 Installation As always, you can install the latest version of the library by running: pip install -U albumentations submitted by /u/alexparinov [link] [comments]  ( 87 min )

I am curious to hear what you usually use to develop interactive versions of your research models! And, if you have any, I'd be excited to see some examples for inspiration 😊. On that note, about 2 weeks ago, I shared an article on developing a Super-Resolution GAN Research Demo in Lightning on r/MachineLearning: Bottom-up look at the new Lightning Framework for building anything from production-ready ML systems to research demos Running research demos locally is not super useful by itself (unless you maybe do that live at a poster session -- I still have painful memories of doing that with privacy GAN demo in Flask), so this is a follow-up article on deploying the App on the Cloud: Sharing Deep Learning Research Models with Lightning Part 2: Leveraging the Cloud. Also, curious to hear what you think! submitted by /u/seraschka [link] [comments]  ( 88 min )

Hello Everyone! My name is Derek, and I am a co-chair for the Workshop on AI for Strategy Games at AIIDE this year. I wanted to share some info about the workshop for those that may be interested in discussing the future of AI for strategy games or looking to publish/get feedback on any work research you are doing with strategy games. Feel free to message me if you have any questions! Workshop website: https://skatgame.net/mburo/aiide22ws/ Submission deadline: July 29, 2022 Topics This workshop welcomes original research contributions, position papers, competition AI system descriptions, and post-mortem game analyses in the area of AI for strategy games --- including modern video strategy games (such as FPS and RTS games), and turn based games and puzzles. Topics include, but are not r…  ( 89 min )

Curious about the usage of the word "large" in the research community and in papers as a descriptor. About 3 years ago, Bert-Large was considered large at 345 million parameters. Today we have a 11-B parameter T-5 model and larger. When describing models in papers, is there consensus as to what we consider a "large" model or set of categories to describe models based on their size? submitted by /u/certain_entropy [link] [comments]  ( 88 min )

When I say "SOTA" I'm talking about recent architectures like ViT, BERT, GPT-like models.. Is it possible to train any of these from scratch (no pre-trained checkpoint) with low resources (Colab, Colab pro) ? submitted by /u/Silver_Doughnut_8175 [link] [comments]  ( 91 min )

Hello members, soo my question is suppose we have a model or architecture at we have an image classifier at the end of it which is trained on mnist images. We need to train the model such that when the image is passed through the classifier it outcomes it's results with some uncertainty in its predictions. We need to use that uncertainty in order to develop a loss function to train the whole model as we can't use the true labels of the images. Any resources or ideas related to above which can be helpful pls share with me. Any suggestions will be appreciated. Thanks submitted by /u/Anonymous_Guy_12 [link] [comments]  ( 86 min )

Hi guys, I am dealing with 1000s of devices distributed over the whole world. These devices log and upload events (e.g. various kinds of device faults) including a time stamp to a database. My tasks now is to analyze these time series of events, detect anomalies and then automatically send notifications about these anomalies. Anomalies I want to detect may include things like: - sudden spikes in the number of events - sudden changes of the type of events - long term drift of the number of events - etc. etc. Any advice on suitable algorithms for this kind of problems and/or according literature would be highly appreciated. Thanks! 👍 submitted by /u/RafiRafiRafiRafi [link] [comments]  ( 93 min )

Hey guys, working on an AES project. Just wanted to know if there exists an AES system that can be trained on languages like Swahili, Arabic, Hindi etc. Languages having almost no AES studies done. Would be very helpful of you to guide me through, any other tips/pointers towards this task are much appreciated, would love it if someone can point me in the right direction. submitted by /u/NeoKoseii [link] [comments]  ( 86 min )

I am very excited to share our latest research: a new framework RankSEG on (image) segmentation. Abs: In this paper, we establish a theoretical foundation of segmentation with respect to the Dice/IoU metrics, including the Bayes rule and Dice/IoU-calibration, analogous to classification-calibration or Fisher consistency in classification. We prove that the existing thresholding-based framework with most operating losses are NOT consistent with respect to the Dice/IoU metrics, and thus may lead to a suboptimal solution. To address this pitfall, we propose a novel consistent ranking-based framework, namely RankDice/RankIoU, inspired by plug-in rules of the Bayes segmentation rule. Three numerical algorithms with GPU parallel execution are developed to implement the proposed framework in lar…  ( 88 min )

We already have architecture(s) which are supposed to fix one of the biggest issues with transformers, namely that they scale quadratically with input size. The performer scales linearly, which should allow for much bigger context windows, yet looking at recent large language models from major players, all of them seem to be using the old transformer save for some minor improvements. The only exception was Flamingo which had to use a Perceiver because images are huge. So why haven't we ditched the transformer yet? submitted by /u/DickMan64 [link] [comments]  ( 92 min )

Anomalib is Machine Library developed by AI researchers from Intel which implements state of the art algorithms for anomaly detection. Anomaly detection is popular use case in the industrial sector and such algorithms can help provide real-time feedback to manufactures on how well their production lines are performing. Anomaly Detection is a challenging problem often due to a biased dataset. Anomalous images can be scare therefore these algorithms are trained on good images in an unsupervised fashion. By learning the normality, upon inference, the models can detect whether images are anomalous or not. Anomalib was built using a PyTorchLightning Backbone and offers an easy way to deploy the models with OpenVino for inference speedup. Link to the github repo: https://github.com/openvinotoolkit/anomalib Link to a tutorial on how to train your custom dataset with anomalib: https://github.com/openvinotoolkit/anomalib/tree/development/docs/blog/001-train-custom-dataset Please feel free to check out the repo and give us your feedback submitted by /u/alder-ice [link] [comments]  ( 87 min )

I think the answer to this question depends on heavily on the area at hand. That is why I am asking here, even though this question has been asked elsewhere a gazillion times. How much does your advisor help/contribute? How often do you meet? I am especially interested in people who have published papers. Who proposed the problem, and then found a solution? how much of that solution was joint work vs either of you submitting ideas to the other and being approved or rejected? how satisfied/dissatisfied do you feel with respect to your advisor? have you had multiple advisors? if so, how do they compare? Let me start by sharing my experience. I always take the initiative when organizing a meeting with my advisor; if I don't say anything, we probably wouldn't meet. I send him biweekly emails with my progress. Usually this entails a write-up explaining my ideas and their development. I think he skims through it, but he definitely does not read it carefully/go through the details. When we have a meeting I generally have to explain the content of the write-up. In terms of the content itself, he tells me whether the ideas/problem seem sound or not, but does not propose improvements. Sometimes, he proposes other ideas that would imply a significant shift of my current work, which honestly I tend to reject because I have already invested a great deal of time to my ideas and I am more emotionally attached to them (I know this latter point isn't good practice). Overall, I don't know how to feel because I don't really know what's generally expected. If I had to chose, however, I'd say I feel mildly satisfied. What's your experience? submitted by /u/carlml [link] [comments]  ( 100 min )

Does anyone know if there exists a NLP model, like Lambda, that takes every conversation attempts to update their weights in order to incorporate it into its training? My thought process would be instead of using attention and a subsection of the conversation to generate a response, it takes everything. Basically everything gets back propagated and adjusts the weights. This way the model might begin to "remember" its previous conversations. This may be a stretch and perhaps I am missing something fundamental, but it seems like an interesting experiment. I'd love to continue this conversation and elaborate more in the comments. submitted by /u/gabe415160 [link] [comments]  ( 84 min )

Hey all, This is a question I've been asking myself lately; what are the fields of ML which show the most promise in helping mankind in non-frivolous ways (e.g. not animojis)? A few years ago I remember an article describing how one of Microsoft's object detection services helped give 'sight' to the blind by describing what's in the room around them through its computer vision. Another one that I found inspiring was about assisting those with locked-in-syndrome by mapping their brain waves and/or eye movement to certain images, words or letters (I forget which). submitted by /u/lituga [link] [comments]  ( 84 min )

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Then you would have a whole new book, which is better to read. ​ Wouldn't that also pass the copyright from the author to the developer of the AI? ​ 2 Question: Is there an AI that really has a realistic voice, which you can use to make audio books? submitted by /u/xXNOdrugsForMEXx [link] [comments]  ( 85 min )

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I was just reading the research paper "Computing machinery and Intelligence", a paper that Alan Turing had published in 1950, and I did not quite understand a section of the paper where he wrote about the parameters of the machine to be considered in the "imitation game". It would be of great help if anyone could explain these parameters , especially the third parameter. ​ https://preview.redd.it/0bcnothvzr891.png?width=630&format=png&auto=webp&s=ddee792f5c451568bc73c368c0c14c8bd09597e4 submitted by /u/Huckleberry-4915 [link] [comments]  ( 87 min )

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​ https://preview.redd.it/ezbng11f6q891.jpg?width=1170&format=pjpg&auto=webp&s=cecad6b5326e492cfe897d78290aec46c197d198 submitted by /u/pixelz_ai [link] [comments]  ( 84 min )

I know there's one or two options for real-time voice changing that don't sound so convincing (that is, they sound robotic). I was wondering if there's anything that might sound better but doesn't operate in real time? I plan on voicing male and female characters in a video and I have plenty of time to edit the voice clips together but I need them to sound convincing. Free stuff is preferred but I'd consider paying money if that's the only way to get good results. submitted by /u/outsm0ked [link] [comments]  ( 86 min )

Hello Everyone! My name is Derek, and I am a co-chair for the Workshop on AI for Strategy Games at AIIDE this year. I wanted to share some info about the workshop for those that may be interested in discussing the future of AI for strategy games or looking to publish/get feedback on any work research you are doing with strategy games. Feel free to message me if you have any questions! Workshop website: https://skatgame.net/mburo/aiide22ws/ Submission deadline: July 29, 2022 Topics This workshop welcomes original research contributions, position papers, competition AI system descriptions, and post-mortem game analyses in the area of AI for strategy games --- including modern video strategy games (such as FPS and RTS games), and turn based games and puzzles. Topics include, but are not r…  ( 87 min )

submitted by /u/Conscious_Heron_9133 [link] [comments]  ( 85 min )

In Sutton's book, page 63, there is this proof/statement: ​ ​ https://preview.redd.it/azjnvai76r891.png?width=711&format=png&auto=webp&s=ecc4f276a986e07247a769ec4d9df4a9d68da194 Can anyone explain or point out some reference that explains: Why is that v*(s) = max q(s,a)? How can I get Eq (3.18)? Thank you! submitted by /u/rlopes404 [link] [comments]  ( 86 min )

Hi, I am using the MPE (https://github.com/openai/multiagent-particle-envs) and I'm planning to use a visual observation. I was wondering, what size should it be? I assume that if it is too large and the agents are only a few, I am wasting lots of compute for nothing and also the noise becomes a lot. But how to find the best size? 60x60x3 for example? submitted by /u/No_Possibility_7588 [link] [comments]  ( 85 min )

Posted by Dan Walker and Dan Liebling, Software Engineers, Google Research People don’t write in the same way that they speak. Written language is controlled and deliberate, whereas transcripts of spontaneous speech (like interviews) are hard to read because speech is disorganized and less fluent. One aspect that makes speech transcripts particularly difficult to read is disfluency, which includes self-corrections, repetitions, and filled pauses (e.g., words like “umm”, and “you know”). Following is an example of a spoken sentence with disfluencies from the LDC CALLHOME corpus: But that's it's not, it's not, it's, uh, it's a word play on what you just said. It takes some time to understand this sentence — the listener must filter out the extraneous words and resolve all of the nots. Remo…  ( 27 min )

Posted by Ethan Dyer and Guy Gur-Ari, Research Scientists, Google Research, Blueshift Team Language models have demonstrated remarkable performance on a variety of natural language tasks — indeed, a general lesson from many works, including BERT, GPT-3, Gopher, and PaLM, has been that neural networks trained on diverse data at large scale in an unsupervised way can perform well on a variety of tasks. Quantitative reasoning is one area in which language models still fall far short of human-level performance. Solving mathematical and scientific questions requires a combination of skills, including correctly parsing a question with natural language and mathematical notation, recalling relevant formulas and constants, and generating step-by-step solutions involving numerical calculations and…  ( 25 min )

I wrote this article for machine learning and analytic professionals in general. Actually, I describe a new visual, simple, intuitive method for supervised classification. It involves synthetic data and explainable AI. But at the same time, I describe in layman’s terms the Riemann Hypothesis (RH). Also, I offer a new perspective on the subject for… Read More »The Riemann Hypothesis in One Picture The post The Riemann Hypothesis in One Picture appeared first on Data Science Central.  ( 21 min )

You can access Amazon SageMaker Studio notebooks from the Amazon SageMaker console via AWS Identity and Access Management (IAM) authenticated federation from your identity provider (IdP), such as Okta. When a Studio user opens the notebook link, Studio validates the federated user’s IAM policy to authorize access, and generates and resolves the presigned URL for […]  ( 6 min )

In part 1 of this series, we demonstrated how to resolve an Amazon SageMaker Studio presigned URL from a corporate network using Amazon private VPC endpoints without traversing the internet. In this post, we will continue to build on top of the previous solution to demonstrate how to build a private API Gateway via Amazon API […]  ( 7 min )

Some things are easy as A, B, C. But when it comes to autonomous vehicles, the key may be in one, two, three. Faction, a Bay Area-based startup and NVIDIA Inception member, is preparing to debut its business-to-business autonomous delivery service, accelerating its commercial deployment with three-wheel production electric vehicles purpose-built for driverless services. In Read article > The post Three Wheeling: Startup Faction Develops Affordable Tri-Wheel AVs on NVIDIA DRIVE appeared first on NVIDIA Blog.  ( 5 min )

Turn the TV on. GeForce NOW is leveling up gaming in the living room. The Samsung Gaming Hub launched today, delivering GeForce NOW natively on 2022 Samsung Smart TVs. Plus, the SHIELD Software Experience Upgrade 9.1 is now rolling out to all NVIDIA SHIELD TVs, delivering new gaming features that improve GeForce NOW. Great living Read article > The post The Gaming Evolution Will Be Televised: GFN Thursday Levels Up the Living Room Experience on New Samsung TVs and More appeared first on NVIDIA Blog.  ( 8 min )

The SI prefixes giga and tera were adopted in 1960. The prefixes eta and peta were adopted in 1975, and zetta and yotta were adopted in 1991. Following this 15-year cadence, we should have adopted a few more prefixes by now. If we ever do introduce new prefixes, what might they be? The latest prefixes […] Speculation on new SI prefixes first appeared on John D. Cook.  ( 5 min )

Blog post miniseries summarizing byteLAKE’s recommendation about hardware platforms to perform CFD Suite’s AI Training at the Edge.  ( 15 min )

FIGS (Fast Interpretable Greedy-tree Sums): A method for building interpretable models by simultaneously growing an ensemble of decision trees in competition with one another. Recent machine-learning advances have led to increasingly complex predictive models, often at the cost of interpretability. We often need interpretability, particularly in high-stakes applications such as in clinical decision-making; interpretable models help with all kinds of things, such as identifying errors, leveraging domain knowledge, and making speedy predictions. In this blog post we’ll cover FIGS, a new method for fitting an interpretable model that takes the form of a sum of trees. Real-world experiments and theoretical results show that FIGS can effectively adapt to a wide range of structure in data, ach…  ( 3 min )

I have a dataset with 7 input features and 1 output.The length of the dataset is just 260, which is small. How can I train a neural network with the help of keras and achieve accuracy of over 80%? What should be the architecture of the deep neural network? submitted by /u/mono1110 [link] [comments]  ( 85 min )

Researchers develop tools to help data scientists make the features used in machine-learning models more understandable for end users.  ( 7 min )

In this paper we establish a bridge between Topological Data Analysis and Geometric Deep Learning, adapting the topological theory of group equivariant non-expansive operators (GENEOs) to act on the space of all graphs weighted on vertices or edges. This is done by showing how the general concept of GENEO can be used to transform graphs and to give information about their structure. This requires the introduction of the new concepts of generalized permutant and generalized permutant measure and the mathematical proof that these concepts allow us to build GENEOs between graphs. An experimental section concludes the paper, illustrating the possible use of our operators to extract information from graphs. This paper is part of a line of research devoted to developing a compositional and geometric theory of GENEOs for Geometric Deep Learning.  ( 2 min )

In contemporary popular music production, drum sound design is commonly performed by cumbersome browsing and processing of pre-recorded samples in sound libraries. One can also use specialized synthesis hardware, typically controlled through low-level, musically meaningless parameters. Today, the field of Deep Learning offers methods to control the synthesis process via learned high-level features and allows generating a wide variety of sounds. In this paper, we present DrumGAN VST, a plugin for synthesizing drum sounds using a Generative Adversarial Network. DrumGAN VST operates on 44.1 kHz sample-rate audio, offers independent and continuous instrument class controls, and features an encoding neural network that maps sounds into the GAN's latent space, enabling resynthesis and manipulation of pre-existing drum sounds. We provide numerous sound examples and a demo of the proposed VST plugin.  ( 2 min )

Privacy and interpretability are two of the important ingredients for achieving trustworthy machine learning. We study the interplay of these two aspects in graph machine learning through graph reconstruction attacks. The goal of the adversary here is to reconstruct the graph structure of the training data given access to model explanations. Based on the different kinds of auxiliary information available to the adversary, we propose several graph reconstruction attacks. We show that additional knowledge of post-hoc feature explanations substantially increases the success rate of these attacks. Further, we investigate in detail the differences between attack performance with respect to three different classes of explanation methods for graph neural networks: gradient-based, perturbation-based, and surrogate model-based methods. While gradient-based explanations reveal the most in terms of the graph structure, we find that these explanations do not always score high in utility. For the other two classes of explanations, privacy leakage increases with an increase in explanation utility. Finally, we propose a defense based on a randomized response mechanism for releasing the explanations which substantially reduces the attack success rate. Our anonymized code is available.  ( 2 min )

Monocular depth is important in many tasks, such as 3D reconstruction and autonomous driving. Deep learning based models achieve state-of-the-art performance in this field. A set of novel approaches for estimating monocular depth consists of transforming the regression task into a classification one. However, there is a lack of detailed descriptions and comparisons for Classification Approaches for Regression (CAR) in the community and no in-depth exploration of their potential for uncertainty estimation. To this end, this paper will introduce a taxonomy and summary of CAR approaches, a new uncertainty estimation solution for CAR, and a set of experiments on depth accuracy and uncertainty quantification for CAR-based models on KITTI dataset. The experiments reflect the differences in the portability of various CAR methods on two backbones. Meanwhile, the newly proposed method for uncertainty estimation can outperform the ensembling method with only one forward propagation.

Human limb motion tracking and recognition plays an important role in medical rehabilitation training, lower limb assistance, prosthetics design for amputees, feedback control for assistive robots, etc. Lightweight wearable sensors, including inertial sensors, surface electromyography sensors, and flexible strain/pressure, are promising to become the next-generation human motion capture devices. Herein, we present a wireless wearable device consisting of a sixteen-channel flexible sponge-based pressure sensor array to recognize various human lower limb motions by detecting contours on the human skin caused by calf gastrocnemius muscle actions. Each sensing element is a round porous structure of thin carbon nanotube/polydimethylsiloxane nanocomposites with a diameter of 4 mm and thickness of about 400 {\mu}m. Ten human subjects were recruited to perform ten different lower limb motions while wearing the developed device. The motion classification result with the support vector machine method shows a macro-recall of about 97.3% for all ten motions tested. This work demonstrates a portable wearable muscle activity detection device with a lower limb motion recognition application, which can be potentially used in assistive robot control, healthcare, sports monitoring, etc.

We propose a message passing algorithm, based on variational Bayesian inference, for low-rank tensor completion with automatic rank determination in the canonical polyadic format when additional side information (SI) is given. The SI comes in the form of low-dimensional subspaces the contain the fiber spans of the tensor (columns, rows, tubes, etc.). We validate the regularization properties induced by SI with extensive numerical experiments on synthetic and real-world data and present the results about tensor recovery and rank determination. The results show that the number of samples required for successful completion is significantly reduced in the presence of SI. We also discuss the origin of a bump in the phase transition curves that exists when the dimensionality of SI is comparable with that of the tensor.

We develop the first fast spectral algorithm to decompose a random third-order tensor over $\mathbb{R}^d$ of rank up to $O(d^{3/2}/\text{polylog}(d))$. Our algorithm only involves simple linear algebra operations and can recover all components in time $O(d^{6.05})$ under the current matrix multiplication time. Prior to this work, comparable guarantees could only be achieved via sum-of-squares [Ma, Shi, Steurer 2016]. In contrast, fast algorithms [Hopkins, Schramm, Shi, Steurer 2016] could only decompose tensors of rank at most $O(d^{4/3}/\text{polylog}(d))$. Our algorithmic result rests on two key ingredients. A clean lifting of the third-order tensor to a sixth-order tensor, which can be expressed in the language of tensor networks. A careful decomposition of the tensor network into a sequence of rectangular matrix multiplications, which allows us to have a fast implementation of the algorithm.

Molecular dynamics (MD) simulation is the workhorse of various scientific domains but is limited by high computational cost. Learning-based force fields have made major progress in accelerating ab-initio MD simulation but are still not fast enough for many real-world applications that require long-time MD simulation. In this paper, we adopt a different machine learning approach where we coarse-grain a physical system using graph clustering, and model the system evolution with a very large time-integration step using graph neural networks. A novel score-based GNN refinement module resolves the long-standing challenge of long-time simulation instability. Despite only trained with short MD trajectory data, our learned simulator can generalize to unseen novel systems and simulate for much longer than the training trajectories. Properties requiring 10-100 ns level long-time dynamics can be accurately recovered at several-orders-of-magnitude higher speed than classical force fields. We demonstrate the effectiveness of our method on two realistic complex systems: (1) single-chain coarse-grained polymers in implicit solvent; (2) multi-component Li-ion polymer electrolyte systems.

Generating multi-contrasts/modal MRI of the same anatomy enriches diagnostic information but is limited in practice due to excessive data acquisition time. In this paper, we propose a novel deep-learning model for joint reconstruction and synthesis of multi-modal MRI using incomplete k-space data of several source modalities as inputs. The output of our model includes reconstructed images of the source modalities and high-quality image synthesized in the target modality. Our proposed model is formulated as a variational problem that leverages several learnable modality-specific feature extractors and a multimodal synthesis module. We propose a learnable optimization algorithm to solve this model, which induces a multi-phase network whose parameters can be trained using multi-modal MRI data. Moreover, a bilevel-optimization framework is employed for robust parameter training. We demonstrate the effectiveness of our approach using extensive numerical experiments.

Lipschitz learning is a graph-based semi-supervised learning method where one extends labels from a labeled to an unlabeled data set by solving the infinity Laplace equation on a weighted graph. In this work we prove uniform convergence rates for solutions of the graph infinity Laplace equation as the number of vertices grows to infinity. Their continuum limits are absolutely minimizing Lipschitz extensions with respect to the geodesic metric of the domain where the graph vertices are sampled from. We work under very general assumptions on the graph weights, the set of labeled vertices, and the continuum domain. Our main contribution is that we obtain quantitative convergence rates even for very sparsely connected graphs, as they typically appear in applications like semi-supervised learning. In particular, our framework allows for graph bandwidths down to the connectivity radius. For proving this we first show a quantitative convergence statement for graph distance functions to geodesic distance functions in the continuum. Using the "comparison with distance functions" principle, we can pass these convergence statements to infinity harmonic functions and absolutely minimizing Lipschitz extensions.

When training neural networks with simulated quantization, we observe that quantized weights can, rather unexpectedly, oscillate between two grid-points. The importance of this effect and its impact on quantization-aware training (QAT) are not well-understood or investigated in literature. In this paper, we delve deeper into the phenomenon of weight oscillations and show that it can lead to a significant accuracy degradation due to wrongly estimated batch-normalization statistics during inference and increased noise during training. These effects are particularly pronounced in low-bit ($\leq$ 4-bits) quantization of efficient networks with depth-wise separable layers, such as MobileNets and EfficientNets. In our analysis we investigate several previously proposed QAT algorithms and show that most of these are unable to overcome oscillations. Finally, we propose two novel QAT algorithms to overcome oscillations during training: oscillation dampening and iterative weight freezing. We demonstrate that our algorithms achieve state-of-the-art accuracy for low-bit (3 & 4 bits) weight and activation quantization of efficient architectures, such as MobileNetV2, MobileNetV3, and EfficentNet-lite on ImageNet. Our source code is available at {https://github.com/qualcomm-ai-research/oscillations-qat}.

Optimal transport is a framework for comparing measures whereby a cost is incurred for transporting one measure to another. Recent works have aimed to improve optimal transport plans through the introduction of various forms of structure. We introduce novel order constraints into the optimal transport formulation to allow for the incorporation of structure. We define an efficient method for obtaining explainable solutions to the new formulation that scales far better than standard approaches. The theoretical properties of the method are provided. We demonstrate experimentally that order constraints improve explainability using the e-SNLI (Stanford Natural Language Inference) dataset that includes human-annotated rationales as well as on several image color transfer examples.

Algorithms and models are increasingly deployed to inform decisions about people, inevitably affecting their lives. As a consequence, those in charge of developing these models must carefully evaluate their impact on different groups of people and favour group fairness, that is, ensure that groups determined by sensitive demographic attributes, such as race or sex, are not treated unjustly. To achieve this goal, the availability (awareness) of these demographic attributes to those evaluating the impact of these models is fundamental. Unfortunately, collecting and storing these attributes is often in conflict with industry practices and legislation on data minimisation and privacy. For this reason, it can be hard to measure the group fairness of trained models, even from within the companies developing them. In this work, we tackle the problem of measuring group fairness under unawareness of sensitive attributes, by using techniques from quantification, a supervised learning task concerned with directly providing group-level prevalence estimates (rather than individual-level class labels). We show that quantification approaches are particularly suited to tackle the fairness-under-unawareness problem, as they are robust to inevitable distribution shifts while at the same time decoupling the (desirable) objective of measuring group fairness from the (undesirable) side effect of allowing the inference of sensitive attributes of individuals. More in detail, we show that fairness under unawareness can be cast as a quantification problem and solved with proven methods from the quantification literature. We show that these methods outperform previous approaches to measure demographic parity in five experimental protocols, corresponding to important challenges that complicate the estimation of classifier fairness under unawareness.

In Bayesian structure learning, we are interested in inferring a distribution over the directed acyclic graph (DAG) structure of Bayesian networks, from data. Defining such a distribution is very challenging, due to the combinatorially large sample space, and approximations based on MCMC are often required. Recently, a novel class of probabilistic models, called Generative Flow Networks (GFlowNets), have been introduced as a general framework for generative modeling of discrete and composite objects, such as graphs. In this work, we propose to use a GFlowNet as an alternative to MCMC for approximating the posterior distribution over the structure of Bayesian networks, given a dataset of observations. Generating a sample DAG from this approximate distribution is viewed as a sequential decision problem, where the graph is constructed one edge at a time, based on learned transition probabilities. Through evaluation on both simulated and real data, we show that our approach, called DAG-GFlowNet, provides an accurate approximation of the posterior over DAGs, and it compares favorably against other methods based on MCMC or variational inference.

Recurrent State-space models (RSSMs) are highly expressive models for learning patterns in time series data and system identification. However, these models assume that the dynamics are fixed and unchanging, which is rarely the case in real-world scenarios. Many control applications often exhibit tasks with similar but not identical dynamics which can be modeled as a latent variable. We introduce the Hidden Parameter Recurrent State Space Models (HiP-RSSMs), a framework that parametrizes a family of related dynamical systems with a low-dimensional set of latent factors. We present a simple and effective way of learning and performing inference over this Gaussian graphical model that avoids approximations like variational inference. We show that HiP-RSSMs outperforms RSSMs and competing multi-task models on several challenging robotic benchmarks both on real-world systems and simulations.

Image-to-image translation (i2i) networks suffer from entanglement effects in presence of physics-related phenomena in target domain (such as occlusions, fog, etc), lowering altogether the translation quality, controllability and variability. In this paper, we build upon collection of simple physics models and present a comprehensive method for disentangling visual traits in target images, guiding the process with a physical model that renders some of the target traits, and learning the remaining ones. Because it allows explicit and interpretable outputs, our physical models (optimally regressed on target) allows generating unseen scenarios in a controllable manner. We also extend our framework, showing versatility to neural-guided disentanglement. The results show our disentanglement strategies dramatically increase performances qualitatively and quantitatively in several challenging scenarios for image translation.

Motivated by the state-of-art psychological research, we note that a piano performance transcribed with existing Automatic Music Transcription (AMT) methods cannot be successfully resynthesized without affecting the artistic content of the performance. This is due to 1) the different mappings between MIDI parameters used by different instruments, and 2) the fact that musicians adapt their way of playing to the surrounding acoustic environment. To face this issue, we propose a methodology to build acoustics-specific AMT systems that are able to model the adaptations that musicians apply to convey their interpretation. Specifically, we train models tailored for virtual instruments in a modular architecture that takes as input an audio recording and the relative aligned music score, and outputs the acoustics-specific velocities of each note. We test different model shapes and show that the proposed methodology generally outperforms the usual AMT pipeline which does not consider specificities of the instrument and of the acoustic environment. Interestingly, such a methodology is extensible in a straightforward way since only slight efforts are required to train models for the inference of other piano parameters, such as pedaling.

The R\'{e}nyi cross-entropy measure between two distributions, a generalization of the Shannon cross-entropy, was recently used as a loss function for the improved design of deep learning generative adversarial networks. In this work, we examine the properties of this measure and derive closed-form expressions for it when one of the distributions is fixed and when both distributions belong to the exponential family. We also analytically determine a formula for the cross-entropy rate for stationary Gaussian processes and for finite-alphabet Markov sources.  ( 2 min )

Security analysts prepare threat analysis upon investigating an attack, an emerging cyber threat, or a recently discovered vulnerability. Threat intelligence on malware attacks and campaigns is shared on blog posts, reports, analyses, and tweets with varying technical details. Other security analysts use this intelligence to inform them of emerging threats, indicators of compromise, attack methods, and preventative measures. Collectively known as threat intelligence, it is typically in an unstructured format and, therefore, challenging to integrate seamlessly into existing IDPS systems. In this paper, we propose a framework that aggregates and combines CTI - the openly available cyber threat intelligence information. The information is extracted and stored in a structured format using knowledge graphs such that the semantics of the threat intelligence can be preserved and shared at scale with other security analysts. We propose the first semi-supervised open-source knowledge graph (KG) framework, TINKER, to capture cyber threat information and its context. Following TINKER, we generate a Cyberthreat Intelligence Knowledge Graph (CTI-KG). We demonstrate the efficacy of CTI-KG using different use cases and its application for security analysts.

While the real world application of reinforcement learning (RL) is becoming popular, the safety concern and the robustness of an RL system require more attention. A recent work reveals that, in a multi-agent RL environment, backdoor trigger actions can be injected into a victim agent (a.k.a. trojan agent), which can result in a catastrophic failure as soon as it sees the backdoor trigger action. We propose the problem of RL Backdoor Detection, aiming to address this safety vulnerability. An interesting observation we drew from extensive empirical studies is a trigger smoothness property where normal actions similar to the backdoor trigger actions can also trigger low performance of the trojan agent. Inspired by this observation, we propose a reinforcement learning solution TrojanSeeker to find approximate trigger actions for the trojan agents, and further propose an efficient approach to mitigate the trojan agents based on machine unlearning. Experiments show that our approach can correctly distinguish and mitigate all the trojan agents across various types of agents and environments.

Optimal transport (OT) theory describes general principles to define and select, among many possible choices, the most efficient way to map a probability measure onto another. That theory has been mostly used to estimate, given a pair of source and target probability measures $(\mu,\nu)$, a parameterized map $T_\theta$ that can efficiently map $\mu$ onto $\nu$. In many applications, such as predicting cell responses to treatments, the data measures $\mu,\nu$ (features of untreated/treated cells) that define optimal transport problems do not arise in isolation but are associated with a context $c$ (the treatment). To account for and incorporate that context in OT estimation, we introduce CondOT, an approach to estimate OT maps conditioned on a context variable, using several pairs of measures $(\mu_i, \nu_i)$ tagged with a context label $c_i$. Our goal is to % extract from a dataset of labeled pairs $\{(c_i, (\mu_i, \nu_i))\}$ learn a global map $\mathcal{T}_{\theta}$ which is not only expected to fit em all pairs in the dataset $\{(c_i, (\mu_i, \nu_i))\}$, i.e., $\mathcal{T}_{\theta}(c_i) \sharp\mu_i \approx \nu_i$, but should generalize to produce meaningful maps $\mathcal{T}_{\theta}(c_{\text{new}})$ conditioned on unseen contexts $c_{\text{new}}$. Our approach harnesses and provides a novel usage for partially input convex neural networks, for which we introduce a robust and efficient initialization strategy inspired by Gaussian approximations. We demonstrate the ability of CondOT to infer the effect of an arbitrary combination of genetic or therapeutic perturbations on single cells, using only observations of the effects of said perturbations separately.  ( 3 min )

Rapid developments of quantum information technology show promising opportunities for simulating quantum field theory in near-term quantum devices. In this work, we formulate the theory of (time-dependent) variational quantum simulation of the 1+1 dimensional $\lambda \phi^4$ quantum field theory including encoding, state preparation, and time evolution, with several numerical simulation results. These algorithms could be understood as near-term variational analogs of the Jordan-Lee-Preskill algorithm, the basic algorithm for simulating quantum field theory using universal quantum devices. Besides, we highlight the advantages of encoding with harmonic oscillator basis based on the LSZ reduction formula and several computational efficiency such as when implementing a bosonic version of the unitary coupled cluster ansatz to prepare initial states. We also discuss how to circumvent the "spectral crowding" problem in the quantum field theory simulation and appraise our algorithm by both state and subspace fidelities.

In learning from label proportions (LLP), the instances are grouped into bags, and the task is to learn an instance classifier given relative class proportions in training bags. LLP is useful when obtaining individual instance labels is impossible or costly. In this work, we focus on the case of small bags, which allows to design an algorithm that explicitly considers all consistent instance label combinations. In particular, we propose an EM algorithm alternating between optimizing a general neural network instance classifier and incorporating bag-level annotations. Using two different image datasets, we experimentally compare this method with an approach based on normal approximation and two existing LLP methods. The results show that our approach converges faster to a comparable or better solution.

Unsupervised detection of anomaly points in time series is a challenging problem, which requires the model to derive a distinguishable criterion. Previous methods tackle the problem mainly through learning pointwise representation or pairwise association, however, neither is sufficient to reason about the intricate dynamics. Recently, Transformers have shown great power in unified modeling of pointwise representation and pairwise association, and we find that the self-attention weight distribution of each time point can embody rich association with the whole series. Our key observation is that due to the rarity of anomalies, it is extremely difficult to build nontrivial associations from abnormal points to the whole series, thereby, the anomalies' associations shall mainly concentrate on their adjacent time points. This adjacent-concentration bias implies an association-based criterion inherently distinguishable between normal and abnormal points, which we highlight through the \emph{Association Discrepancy}. Technically, we propose the \emph{Anomaly Transformer} with a new \emph{Anomaly-Attention} mechanism to compute the association discrepancy. A minimax strategy is devised to amplify the normal-abnormal distinguishability of the association discrepancy. The Anomaly Transformer achieves state-of-the-art results on six unsupervised time series anomaly detection benchmarks of three applications: service monitoring, space & earth exploration, and water treatment.

Coreset selection, which aims to select a subset of the most informative training samples, is a long-standing learning problem that can benefit many downstream tasks such as data-efficient learning, continual learning, neural architecture search, active learning, etc. However, many existing coreset selection methods are not designed for deep learning, which may have high complexity and poor generalization performance. In addition, the recently proposed methods are evaluated on models, datasets, and settings of different complexities. To advance the research of coreset selection in deep learning, we contribute a comprehensive code library, namely DeepCore, and provide an empirical study on popular coreset selection methods on CIFAR10 and ImageNet datasets. Extensive experiments on CIFAR10 and ImageNet datasets verify that, although various methods have advantages in certain experiment settings, random selection is still a strong baseline.

Out-of-distribution (OOD) detection is important for machine learning models deployed in the wild. Recent methods use auxiliary outlier data to regularize the model for improved OOD detection. However, these approaches make a strong distributional assumption that the auxiliary outlier data is completely separable from the in-distribution (ID) data. In this paper, we propose a novel framework that leverages wild mixture data, which naturally consists of both ID and OOD samples. Such wild data is abundant and arises freely upon deploying a machine learning classifier in their natural habitats. Our key idea is to formulate a constrained optimization problem and to show how to tractably solve it. Our learning objective maximizes the OOD detection rate, subject to constraints on the classification error of ID data and on the OOD error rate of ID examples. We extensively evaluate our approach on common OOD detection tasks and demonstrate superior performance.

Reinforcement learning algorithms require many samples when solving complex hierarchical tasks with sparse and delayed rewards. For such complex tasks, the recently proposed RUDDER uses reward redistribution to leverage steps in the Q-function that are associated with accomplishing sub-tasks. However, often only few episodes with high rewards are available as demonstrations since current exploration strategies cannot discover them in reasonable time. In this work, we introduce Align-RUDDER, which utilizes a profile model for reward redistribution that is obtained from multiple sequence alignment of demonstrations. Consequently, Align-RUDDER employs reward redistribution effectively and, thereby, drastically improves learning on few demonstrations. Align-RUDDER outperforms competitors on complex artificial tasks with delayed rewards and few demonstrations. On the Minecraft ObtainDiamond task, Align-RUDDER is able to mine a diamond, though not frequently. Code is available at https://github.com/ml-jku/align-rudder. YouTube: https://youtu.be/HO-_8ZUl-UY

We study GPT-3, a recent large language model, using tools from cognitive psychology. More specifically, we assess GPT-3's decision-making, information search, deliberation, and causal reasoning abilities on a battery of canonical experiments from the literature. We find that much of GPT-3's behavior is impressive: it solves vignette-based tasks similarly or better than human subjects, is able to make decent decisions from descriptions, outperforms humans in a multi-armed bandit task, and shows signatures of model-based reinforcement learning. Yet we also find that small perturbations to vignette-based tasks can lead GPT-3 vastly astray, that it shows no signatures of directed exploration, and that it fails miserably in a causal reasoning task. These results enrich our understanding of current large language models and pave the way for future investigations using tools from cognitive psychology to study increasingly capable and opaque artificial agents.  ( 2 min )

Modeling continuous dynamical systems from discretely sampled observations is a fundamental problem in data science. Often, such dynamics are the result of non-local processes that present an integral over time. As such, these systems are modeled with Integro-Differential Equations (IDEs); generalizations of differential equations that comprise both an integral and a differential component. For example, brain dynamics are not accurately modeled by differential equations since their behavior is non-Markovian, i.e. dynamics are in part dictated by history. Here, we introduce the Neural IDE (NIDE), a framework that models ordinary and integral components of IDEs using neural networks. We test NIDE on several toy and brain activity datasets and demonstrate that NIDE outperforms other models, including Neural ODE. These tasks include time extrapolation as well as predicting dynamics from unseen initial conditions, which we test on whole-cortex activity recordings in freely behaving mice. Further, we show that NIDE can decompose dynamics into its Markovian and non-Markovian constituents, via the learned integral operator, which we test on fMRI brain activity recordings of people on ketamine. Finally, the integrand of the integral operator provides a latent space that gives insight into the underlying dynamics, which we demonstrate on wide-field brain imaging recordings. Altogether, NIDE is a novel approach that enables modeling of complex non-local dynamics with neural networks.  ( 3 min )

Heterogeneous tabular data are the most commonly used form of data and are essential for numerous critical and computationally demanding applications. On homogeneous data sets, deep neural networks have repeatedly shown excellent performance and have therefore been widely adopted. However, their adaptation to tabular data for inference or data generation tasks remains challenging. To facilitate further progress in the field, this work provides an overview of state-of-the-art deep learning methods for tabular data. We categorize these methods into three groups: data transformations, specialized architectures, and regularization models. For each of these groups, our work offers a comprehensive overview of the main approaches. Moreover, we discuss deep learning approaches for generating tabular data, and we also provide an overview over strategies for explaining deep models on tabular data. Thus, our first contribution is to address the main research streams and existing methodologies in the mentioned areas, while highlighting relevant challenges and open research questions. Our second contribution is to provide an empirical comparison of traditional machine learning methods with eleven deep learning approaches across five popular real-world tabular data sets of different sizes and with different learning objectives. Our results, which we have made publicly available as competitive benchmarks, indicate that algorithms based on gradient-boosted tree ensembles still mostly outperform deep learning models on supervised learning tasks, suggesting that the research progress on competitive deep learning models for tabular data is stagnating. To the best of our knowledge, this is the first in-depth overview of deep learning approaches for tabular data; as such, this work can serve as a valuable starting point to guide researchers and practitioners interested in deep learning with tabular data.

For the highly imbalanced credit card fraud detection problem, most existing methods either use data augmentation methods or conventional machine learning models, while neural network-based anomaly detection approaches are lacking. Furthermore, few studies have employed AI interpretability tools to investigate the feature importance of transaction data, which is crucial for the black-box fraud detection module. Considering these two points together, we propose a novel anomaly detection framework for credit card fraud detection as well as a model-explaining module responsible for prediction explanations. The fraud detection model is composed of two deep neural networks, which are trained in an unsupervised and adversarial manner. Precisely, the generator is an AutoEncoder aiming to reconstruct genuine transaction data, while the discriminator is a fully-connected network for fraud detection. The explanation module has three white-box explainers in charge of interpretations of the AutoEncoder, discriminator, and the whole detection model, respectively. Experimental results show the state-of-the-art performances of our fraud detection model on the benchmark dataset compared with baselines. In addition, prediction analyses by three explainers are presented, offering a clear perspective on how each feature of an instance of interest contributes to the final model output.

The acoustic environment can degrade speech quality during communication (e.g., video call, remote presentation, outside voice recording), and its impact is often unknown. Objective metrics for speech quality have proven challenging to develop given the multi-dimensionality of factors that affect speech quality and the difficulty of collecting labeled data. Hypothesizing the impact of acoustics on speech quality, this paper presents MOSRA: a non-intrusive multi-dimensional speech quality metric that can predict room acoustics parameters (SNR, STI, T60, DRR, and C50) alongside the overall mean opinion score (MOS) for speech quality. By explicitly optimizing the model to learn these room acoustics parameters, we can extract more informative features and improve the generalization for the MOS task when the training data is limited. Furthermore, we also show that this joint training method enhances the blind estimation of room acoustics, improving the performance of current state-of-the-art models. An additional side-effect of this joint prediction is the improvement in the explainability of the predictions, which is a valuable feature for many applications.  ( 2 min )

Medical report generation task, which targets to produce long and coherent descriptions of medical images, has attracted growing research interests recently. Different from the general image captioning tasks, medical report generation is more challenging for data-driven neural models. This is mainly due to 1) the serious data bias and 2) the limited medical data. To alleviate the data bias and make best use of available data, we propose a Competence-based Multimodal Curriculum Learning framework (CMCL). Specifically, CMCL simulates the learning process of radiologists and optimizes the model in a step by step manner. Firstly, CMCL estimates the difficulty of each training instance and evaluates the competence of current model; Secondly, CMCL selects the most suitable batch of training instances considering current model competence. By iterating above two steps, CMCL can gradually improve the model's performance. The experiments on the public IU-Xray and MIMIC-CXR datasets show that CMCL can be incorporated into existing models to improve their performance.  ( 2 min )

With the fast development of quantum computing and deep learning, quantum neural networks have attracted great attention recently. By leveraging the power of quantum computing, deep neural networks can potentially overcome computational power limitations in classic machine learning. However, when multiple quantum machines wish to train a global model using the local data on each machine, it may be very difficult to copy the data into one machine and train the model. Therefore, a collaborative quantum neural network framework is necessary. In this article, we borrow the core idea of federated learning to propose QuantumFed, a quantum federated learning framework to have multiple quantum nodes with local quantum data train a mode together. Our experiments show the feasibility and robustness of our framework.

In this work, we study the possibility of defending against data-poisoning attacks while training a shallow neural network in a regression setup. We focus on doing supervised learning for a class of depth-2 finite-width neural networks, which includes single-filter convolutional networks. In this class of networks, we attempt to learn the network weights in the presence of a malicious oracle doing stochastic, bounded and additive adversarial distortions on the true output during training. For the non-gradient stochastic algorithm that we construct, we prove worst-case near-optimal trade-offs among the magnitude of the adversarial attack, the weight approximation accuracy, and the confidence achieved by the proposed algorithm. As our algorithm uses mini-batching, we analyze how the mini-batch size affects convergence. We also show how to utilize the scaling of the outer layer weights to counter output-poisoning attacks depending on the probability of attack. Lastly, we give experimental evidence demonstrating how our algorithm outperforms stochastic gradient descent under different input data distributions, including instances of heavy-tailed distributions.